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Substance Name: Cyclohexyl butyrate
RN: 1551-44-6
UNII: FHH53Z3I16
InChIKey: VZHUBBUZNIULNM-UHFFFAOYSA-N
Molecular Formula
- C10-H18-O2
Molecular Weight
- 170.2502
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Results Name
- Cyclohexyl butyrate
Name of Substance
- Cyclohexyl butyrate
Synonyms
- 4-06-00-00037 (Beilstein Handbook Reference)
- AI3-06059
- BRN 2083414
- Butanoic acid, cyclohexyl ester
- Butyric acid, cyclohexyl ester
- CCRIS 6553
- Cyclohexanyl butyrate
- Cyclohexyl butanoate
- Cyclohexyl butyrate
- EINECS 216-290-9
- FEMA No. 2351
- NSC 53950
- UNII-FHH53Z3I16
Systematic Names
- Butanoic acid, cyclohexyl ester
- Butyric acid, cyclohexyl ester
- Cyclohexyl butyrate
Superlist Name
- Cyclohexyl butyrate
Registry Numbers
CAS Registry Number
- 1551-44-6
FDA UNII
- FHH53Z3I16
System Generated Number
- 0001551446
Structure Descriptors
InChI
InChI=1S/C10H18O2/c1-2-6-10(11)12-9-7-4-3-5-8-9/h9H,2-8H2,1H3InChIKey
VZHUBBUZNIULNM-UHFFFAOYSA-NSmiles
CCCC(=O)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| guinea pig | LD50 | skin | > 5gm/kg (5000mg/kg) | Food and Chemical Toxicology. Vol. 26, Pg. 293, 1988. | |
| rat | LDLo | oral | 5gm/kg (5000mg/kg) | Food and Chemical Toxicology. Vol. 26, Pg. 293, 1988. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Boiling Point | 213 | deg C | EXP | |
| log P (octanol-water) | 3.620 | (none) | EST | |
| Atmospheric OH Rate Constant | 1.34E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.