1-[(2-Chloroacetyl)amino]cyclopentane-1-carboxylic acid
Basic information
- CAS
90153-48-3- Standard SMILES
O=C(CCl)NC1(C(=O)O)CCCC1- InChIKey
BVCPTEHXMAJCFC-UHFFFAOYSA-N- Molecular formula
- C8H12ClNO3
- Average molar mass
- 205.64 g/mol
- Monoisotopic mass
- 205.0505709
Names & identifiers
- Preferred name
- 1-[(2-Chloroacetyl)amino]cyclopentane-1-carboxylic acid
- IUPAC
- 1-[(2-chloroacetyl)amino]cyclopentane-1-carboxylic acid
Names & synonyms
90153-48-31-[(2-chloroacetyl)amino]cyclopentane-1-carboxylic acidMLS0031152111-(2-chloroacetamido)cyclopentane-1-carboxylic acidNIOSH/GY2625700CB 17321-Chloroacetylaminocyclopentanecarboxylic acidGY262570001-(2-Chloroacetamido)cyclopentanecarboxylic acidCyclopentanecarboxylic acid, 1-(2-chloroacetamido)-NSC240502CHEMBL2133604
Show more names
DTXSID70311216NSC-240502SMR001830793
Database identifiers
- CAS
90153-48-3- PubChem CID
- 315364
- DTXSID
DTXSID70311216- ChEMBL
CHEMBL2133604
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 223
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Compound notes
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