N-Ethylidene-4-propyl-4-heptanamine

HCID 47397

Notes Reactions

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Basic information

CAS: 64467-60-3
Standard SMILES: CC=NC(CCC)(CCC)CCC
InChIKey: AOSWAYINXPKDRV-UHFFFAOYSA-N
Molecular formula: C12H25N
Average molar mass: 183.33 g/mol
Monoisotopic mass: 183.1986998

Names & identifiers

Preferred name: N-Ethylidene-4-propyl-4-heptanamine
IUPAC: N-(4-propylheptan-4-yl)ethanimine

Names & synonyms

N-Ethylidene-4-propyl-4-heptanamine64467-60-3LCG 21670BRN 22393894-HEPTANAMINE, N-ETHYLIDENE-4-PROPYL-SCHEMBL11429352SCHEMBL11429357AOSWAYINXPKDRV-UHFFFAOYSA-NN-ethylidene-1,1-di-n-propyl-n-butylamine

Database identifiers

CAS: 64467-60-3
PubChem CID: 47397

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 12.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 7
Heavy atoms: 13
Formal charge: 0
Complexity: 121

Related reactions

3 records

New reaction record

HRID 939235As reactantValidation data from https://doi.org/10.1039/C8SC04228D

HRID 1395025As reactantuspto-grants-1980_05

HRID 1439014As reactantuspto-grants-1977_11

Compound notes

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