Benzyl alcohol, alpha-((sec-butylamino)methyl)-p-cyclopropyl-, hydrochloride

HCID 34650

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Basic information

CAS: 29632-42-6
Standard SMILES: CCC(C)[NH2+]CC(O)c1ccc(C2CC2)cc1.[Cl-]
InChIKey: ULSNABQCQDJVPB-UHFFFAOYSA-N
Molecular formula: C15H24ClNO
Average molar mass: 269.81 g/mol
Monoisotopic mass: 269.1546421

Names & identifiers

Preferred name: Benzyl alcohol, alpha-((sec-butylamino)methyl)-p-cyclopropyl-, hydrochloride
IUPAC: butan-2-yl-[2-(4-cyclopropylphenyl)-2-hydroxyethyl]azanium chloride

Names & synonyms

alpha-((sec-Butylamino)methyl)-p-cyclopropyl-benzyl alcohol hydrochloride29632-42-6BENZYL ALCOHOL, alpha-((sec-BUTYLAMINO)METHYL)-p-CYCLOPROPYL-, HYDROCHLORIDERefChem:328584

Database identifiers

CAS: 29632-42-6
PubChem CID: 34650

Properties

Computed structural properties

Topological polar surface area: 36.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 6
Heavy atoms: 18
Formal charge: 0
Complexity: 219

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