2-Chloro-N-(2-propylpentyl)ethanimidic acid

HCID 218533

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Basic information

CAS: 40755-28-0
Standard SMILES: CCCC(CCC)CNC(=O)CCl
InChIKey: HEDPHTJERDKBOZ-UHFFFAOYSA-N
Molecular formula: C10H20ClNO
Average molar mass: 205.72 g/mol
Monoisotopic mass: 205.123342

Names & identifiers

Preferred name: 2-Chloro-N-(2-propylpentyl)ethanimidic acid
IUPAC: 2-chloro-N-(2-propylpentyl)acetamide

Names & synonyms

DTXSID4096118140755-28-02-Chloro-N-(2-propylpentyl)ethanimidic acidRefChem:1062815DTXCID1013890142-Chloro-N-(2-propylpentyl)acetamideAcetamide, 2-chloro-N-(2-propylpentyl)-Chloro-N-(2-propylpentyl)ethanimidic acid

Database identifiers

CAS: 40755-28-0
PubChem CID: 218533
DTXSID: DTXSID40961181

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 7
Heavy atoms: 13
Formal charge: 0
Complexity: 133

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