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推荐答案:symmacros回复于2013/07/25
10-Oxahexadecanolide   

Comprehensive Computer Generated Synopsis   

Synonyms
1,8-Dioxacycloheptadecan-9-one  CAS EINECS IUPAC 
9-[(6-Hydoxyhexyl)oxy]nonanoic acid omicron-lactone 
10-Oxahexadecanolide  Principal 
Oxalide 
10-オキサ-ヘキサデカノリド  METI 
 



Another Material 
CAS Number  RIFM ID FEMA EINECS/ELINCS METI/ENCS ECL Registration
1725-01-5  89    217-033-3
EC#217-033-3  (5)-3878  EINECS DSL TSCA 

--------------------------------------------------------------------------------

10-Oxahexadecanolide
is an isomer of  3391-83-1 990  222-225-5 (5)-3879  EINECS DSL TSCA 
11-Oxahexadecanolide

--------------------------------------------------------------------------------

6707-60-4 991  229-755-6  EINECS DSL TSCA 
12-Oxahexadecanolide

--------------------------------------------------------------------------------


RIFM Monograph: 89 (Published 1992: FCT,v30,p99S, Special Issue VIII)

Fragrance Structure-Activity Group Macrocyclic Lactones and Lactides

RIFM Expert Panel Summary Materials Related to Macrocyclic Lactones and Lactides

Formula C15H28O3 Molecular Weight 256.39
SMILES Notation  O=C(OCCCCCCOCCCCCCC1)C1
Generic Class (TSCA)  Lactones 
Description  Colorless to pale yellowish viscous liquid; sweet, soft and extremely tenacious, discretely animal-musky odor Arctander Volume II 1969: Colorless viscous liquid. Practically insoluble in water, soluble in alcohol and miscible with all perfume materials. Sweet, soft and extremely tenacious discretely animal musky odor. Although the title material has notes resembling versalide and ethylene brassylate. 
Added to RIFM/FEMA Database 1984



Physical Data
Acid Value  not more than 1.0    RIFM 
Boiling Point (calculated)  380.27 °C    EPI Suite 
Henry's Law (calculated)  2.043e-005 Pa·m3/mol    EPI Suite 
Log KOW (calculated)  4.9    EPI Suite 
Melting Point (calculated)  46.8 °C    EPI Suite 
Refractive Index  1.466-1.470 @ 20°C    RIFM 
Specific Gravity  0.976-0.984 @ 25/25C    RIFM 
Specific Gravity  0.990    FMA 
UV Spectra  1      Takasago 
Vapor Pressure (calculated)  0.00000775mmHg @ 20°C    EPI Suite 4.0 
Vapor Pressure (calculated)  1.58e-005 mm Hg @ 25°C    EPI Suite 
Water Solubility (calculated)  1.433 mg/L    EPI Suite 

Natural Occurrence  10-Oxahexadecanolide has apparently not been reported to occur in nature. 

--------------------------------------------------------------------------------

REACH
European EFFA P and I Survey
Range (Metric Tons) Structure Activity Group Survey
1-10 Macrocyclic Lactones and Lactides 2006

Status
Indicative Non-Exhaustive List: Listed 
The Industrial Safety and Health Law (Japan): ISHL Number ( (5)-3878) 
United Nations Transport Classification Codes: Not regulated 

European Hazard Classification Labeling 
NC Based on available data, classification and labeling was not considered necessary as per the EFFA Code of Practice. 
 
 
US OSHA Health Hazard Statements 
Irritation Data IR1 Liquid may be irritating to skin and eyes.
Global Harmonized System Hazard Statements 
Hazard Category Symbol Signal Word Hazard Statement
SCI 3  Warning H316 Causes mild skin irritation 
Precautionary Code Precautionary Statement 
P332/313 If skin irritation occurs: Get medical advice/attention 

Original FFIDS Volume NEW
12/88

Published FFIDS

Human Health Data
Environmental Data
Other References to 10-Oxahexadecanolide
RIFM - FEMA Database



--------------------------------------------------------------------------------

Evaluation Priorities
SA    6  28-Jun-10
Structure Alert Components 
Rules Topical Effects Systemic Effects Carcinogenic Effects Volume Score Concentration
Level Score
14 0 4 0 2 0
14 Heterocycles except lactones with a ring size >4   
Ford R.A., Domeyer B., Easterday O., Maier K. and Middleton J. (2000) Criteria for development of a database for safety evaluation of fragrance ingredients. Regulatory Toxicology and Pharmacology, 31, 166-181. 
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everlastingz
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牛二
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原文由 everlastingz(everlastingz) 发表:

帮顶了。。。。。。


symmacros
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10-Oxahexadecanolide   

Comprehensive Computer Generated Synopsis   

Synonyms
1,8-Dioxacycloheptadecan-9-one  CAS EINECS IUPAC 
9-[(6-Hydoxyhexyl)oxy]nonanoic acid omicron-lactone 
10-Oxahexadecanolide  Principal 
Oxalide 
10-オキサ-ヘキサデカノリド  METI 
 



Another Material 
CAS Number  RIFM ID FEMA EINECS/ELINCS METI/ENCS ECL Registration
1725-01-5  89    217-033-3
EC#217-033-3  (5)-3878  EINECS DSL TSCA 

--------------------------------------------------------------------------------

10-Oxahexadecanolide
is an isomer of  3391-83-1 990  222-225-5 (5)-3879  EINECS DSL TSCA 
11-Oxahexadecanolide

--------------------------------------------------------------------------------

6707-60-4 991  229-755-6  EINECS DSL TSCA 
12-Oxahexadecanolide

--------------------------------------------------------------------------------


RIFM Monograph: 89 (Published 1992: FCT,v30,p99S, Special Issue VIII)

Fragrance Structure-Activity Group Macrocyclic Lactones and Lactides

RIFM Expert Panel Summary Materials Related to Macrocyclic Lactones and Lactides

Formula C15H28O3 Molecular Weight 256.39
SMILES Notation  O=C(OCCCCCCOCCCCCCC1)C1
Generic Class (TSCA)  Lactones 
Description  Colorless to pale yellowish viscous liquid; sweet, soft and extremely tenacious, discretely animal-musky odor Arctander Volume II 1969: Colorless viscous liquid. Practically insoluble in water, soluble in alcohol and miscible with all perfume materials. Sweet, soft and extremely tenacious discretely animal musky odor. Although the title material has notes resembling versalide and ethylene brassylate. 
Added to RIFM/FEMA Database 1984



Physical Data
Acid Value  not more than 1.0    RIFM 
Boiling Point (calculated)  380.27 °C    EPI Suite 
Henry's Law (calculated)  2.043e-005 Pa·m3/mol    EPI Suite 
Log KOW (calculated)  4.9    EPI Suite 
Melting Point (calculated)  46.8 °C    EPI Suite 
Refractive Index  1.466-1.470 @ 20°C    RIFM 
Specific Gravity  0.976-0.984 @ 25/25C    RIFM 
Specific Gravity  0.990    FMA 
UV Spectra  1      Takasago 
Vapor Pressure (calculated)  0.00000775mmHg @ 20°C    EPI Suite 4.0 
Vapor Pressure (calculated)  1.58e-005 mm Hg @ 25°C    EPI Suite 
Water Solubility (calculated)  1.433 mg/L    EPI Suite 

Natural Occurrence  10-Oxahexadecanolide has apparently not been reported to occur in nature. 

--------------------------------------------------------------------------------

REACH
European EFFA P and I Survey
Range (Metric Tons) Structure Activity Group Survey
1-10 Macrocyclic Lactones and Lactides 2006

Status
Indicative Non-Exhaustive List: Listed 
The Industrial Safety and Health Law (Japan): ISHL Number ( (5)-3878) 
United Nations Transport Classification Codes: Not regulated 

European Hazard Classification Labeling 
NC Based on available data, classification and labeling was not considered necessary as per the EFFA Code of Practice. 
 
 
US OSHA Health Hazard Statements 
Irritation Data IR1 Liquid may be irritating to skin and eyes.
Global Harmonized System Hazard Statements 
Hazard Category Symbol Signal Word Hazard Statement
SCI 3  Warning H316 Causes mild skin irritation 
Precautionary Code Precautionary Statement 
P332/313 If skin irritation occurs: Get medical advice/attention 

Original FFIDS Volume NEW
12/88

Published FFIDS

Human Health Data
Environmental Data
Other References to 10-Oxahexadecanolide
RIFM - FEMA Database



--------------------------------------------------------------------------------

Evaluation Priorities
SA    6  28-Jun-10
Structure Alert Components 
Rules Topical Effects Systemic Effects Carcinogenic Effects Volume Score Concentration
Level Score
14 0 4 0 2 0
14 Heterocycles except lactones with a ring size >4   
Ford R.A., Domeyer B., Easterday O., Maier K. and Middleton J. (2000) Criteria for development of a database for safety evaluation of fragrance ingredients. Regulatory Toxicology and Pharmacology, 31, 166-181. 
symmacros
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everlastingz
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原文由 symmacros(jimzhu) 发表:
oxalide



朱老师 前面那个小峰 是杂质是吧
symmacros
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原文由 everlastingz(everlastingz) 发表:
原文由 symmacros(jimzhu) 发表:
oxalide



朱老师 前面那个小峰 是杂质是吧


是的。
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