N-(2-Propylpentyl)ethanimidic acid

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Basic information

CAS: 40755-25-7
Standard SMILES: CCCC(CCC)CNC(C)=O
InChIKey: FMGNAQVCZOEKAV-UHFFFAOYSA-N
Molecular formula: C10H21NO
Average molar mass: 171.28 g/mol
Monoisotopic mass: 171.16231429

Names & identifiers

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

Names & synonyms

40755-25-7DTXSID80961180N-(2-Propylpentyl)ethanimidic acidRefChem:1091092DTXCID401389013N-(2-Propylpentyl)acetamideBRN 2430289Acetamide, N-(2-propylpentyl)-SCHEMBL14397158

Database identifiers

CAS: 40755-25-7
PubChem CID: 218531
DTXSID: DTXSID80961180

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 6
Heavy atoms: 12
Formal charge: 0
Complexity: 117

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Compound notes

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