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Substance Name: Cyclohexyl acetate
RN: 622-45-7
UNII: UL0RS4H1UE
InChIKey: YYLLIJHXUHJATK-UHFFFAOYSA-N
Classification Codes
- Human Data
- Skin / Eye Irritant
Molecular Formula
- C8-H14-O2
Molecular Weight
- 142.197
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- Cyclohexyl acetate
Synonyms
- 4-06-00-00036 (Beilstein Handbook Reference)
- Acetic acid, cyclohexyl ester
- Adronal acetate
- AI3-03294
- BRN 1906543
- Cyclohexane acetate
- Cyclohexanol, acetate
- Cyclohexanolazetat
- Cyclohexanolazetat [German]
- Cyclohexanyl acetate
- Cyclohexyl acetate
- Cyclohexylester kyseliny octove
- Cyclohexylester kyseliny octove [Czech]
- EINECS 210-736-6
- FEMA No. 2349
- Hexalin acetate
- HSDB 2820
- NSC 8772
- UNII-UL0RS4H1UE
Systematic Names
- Acetic acid, cyclohexyl ester
- Cyclohexyl acetate
Superlist Names
- Cyclohexyl acetate
- Cyclohexyl acetate [UN2243] [Flammable liquid]
- UN2243
Registry Numbers
CAS Registry Number
- 622-45-7
FDA UNII
- UL0RS4H1UE
System Generated Number
- 0000622457
Structure Descriptors
InChI
InChI=1S/C8H14O2/c1-7(9)10-8-5-3-2-4-6-8/h8H,2-6H2,1H3InChIKey
YYLLIJHXUHJATK-UHFFFAOYSA-NSmiles
CC(=O)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| cat | LDLo | subcutaneous | 800mg/kg (800mg/kg) | Archiv fuer Hygiene. Vol. 78, Pg. 260, 1913. | |
| human | TCLo | inhalation | 3000mg/m3/45M (3000mg/m3) | LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES SENSE ORGANS AND SPECIAL SENSES: CONJUNCTIVE IRRITATION: EYE | Archiv fuer Hygiene. Vol. 78, Pg. 260, 1913. |
| rabbit | LD50 | skin | 10mL/kg (10mL/kg) | Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974. | |
| rat | LD50 | oral | 6730uL/kg (6.73mL/kg) | Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | -6.50E+01 | deg C | EXP | |
| Boiling Point | 173 | deg C | EXP | |
| log P (octanol-water) | 2.640 | (none) | EST | |
| Water Solubility | 728 | mg/L | 25 | EST |
| Henry's Law Constant | 1.20E-04 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 1.18E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.