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Substance Name: 3-Hexenyl salicylate
RN: 65405-77-8
UNII: C78Y9OR6YH
InChIKey: IEPWIPZLLIOZLU-ONEGZZNKSA-N
Classification Code
- Skin / Eye Irritant
Molecular Formula
- C13-H16-O3
Molecular Weight
- 220.266
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Names and Synonyms
Name of Substance
- 3-Hexenyl salicylate
Synonyms
- Benzoic acid, 2-hydroxy-, 3-hexenyl ester, (Z)-
- beta,gamma-cis-Hexenyl salicylate
- cis-3-Hexenyl salicylate
- EC 265-745-8
- EINECS 265-745-8
- UNII-C78Y9OR6YH
Systematic Names
- (Z)-3-Hexenyl salicylate
- 2-Hydroxybenzoic acid, (Z)-3-hexenyl ester
- Benzoic acid, 2-hydroxy-, (3Z)-3-hexen-1-yl ester
- Benzoic acid, 2-hydroxy-, (3Z)-3-hexenyl ester
- Benzoic acid, 2-hydroxy-, 3-hexenyl ester, (Z)-
- Salicylic acid, 3-hexen-1-yl ester
Registry Numbers
CAS Registry Number
- 65405-77-8
FDA UNII
- C78Y9OR6YH
System Generated Number
- 0065405778
Structure Descriptors
InChI
InChI=1S/C13H16O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h3-6,8-9,14H,2,7,10H2,1H3/b4-3+InChIKey
IEPWIPZLLIOZLU-ONEGZZNKSA-NSmiles
CC\C=C\CCOC(=O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rabbit | LD50 | skin | > 5gm/kg (5000mg/kg) | Food and Cosmetics Toxicology. Vol. 17, Pg. 373, 1979. | |
rat | LD50 | oral | 5gm/kg (5000mg/kg) | Food and Cosmetics Toxicology. Vol. 17, Pg. 373, 1979. |