Carbamic acid, isopentyl-, 2-chloroethyl ester
Basic information
- CAS
60452-10-0- Standard SMILES
CC(C)CCNC(=O)OCCCl- InChIKey
FEVLZVPDOYMPQW-UHFFFAOYSA-N- Molecular formula
- C8H16ClNO2
- Average molar mass
- 193.67 g/mol
- Monoisotopic mass
- 193.0869564
Names & identifiers
- Preferred name
- Carbamic acid, isopentyl-, 2-chloroethyl ester
- IUPAC
- 2-chloroethyl N-(3-methylbutyl)carbamate
Names & synonyms
Isopentylcarbamic acid 2-chloroethyl esterCARBAMIC ACID, ISOPENTYL-, 2-CHLOROETHYL ESTERBRN 170529160452-10-0Carbamic acid, (3-methylbutyl)-, 2-chloroethyl esterDTXSID802091954-04-00-00702 (Beilstein Handbook Reference)RefChem:332469DTXCID001316862-Chloroethyl (3-methylbutyl)carbamate
Database identifiers
- CAS
60452-10-0- PubChem CID
- 43273
- DTXSID
DTXSID80209195
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 128
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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