Dicyclohexylamine

Synonyms: N-Cyclohexylcyclohexanamine, "DCHA", "Cyclohexanamine, N-cyclohexyl-", "Dicha", "N,N-Dicyclohexylamine", "Dodecahydrodiphenylamine", "Dicyklohexylamin", "N,N-Diclohexylamine", "N-Cyclohexyl-cyclohexylamine"

Source: Dicyclohexylamine is used as both an enzyme inhibitor and an important initiator in chemical synthesis.

Identifiers:

IUPAC Name: N-cyclohexylcyclohexanamine
CAS Number: 101-83-7
PubChem ID: 7582
InChiKey: XBPCUCUWBYBCDP-UHFFFAOYSA-N
Canonical SMILES: C1CCC(CC1)NC2CCCCC2

Structural Properties:

Molecular Formula: C₁₂H₂₃N
Molecular Weight: 181,320

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 1
Number of atoms different from hydrogen: 13

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Evidence Supporting This Chemical as an Emerging Contaminant

Liu, R., Li, Y., Lin, Y., Ruan, T., & Jiang, G. (2019). Emerging aromatic secondary amine contaminants and related derivatives in various dust matrices in China. Ecotoxicology and environmental safety, 170, 657-663.

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2D-structure

3D-structure