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Benzyl alcohol, alpha-(1-((p-chlorobenzyl)amino)ethyl)-, hydrochloride

HCID 29312
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Basic information

CAS
18864-08-9
Standard SMILES
OC(CC[NH2+]Cc1ccc(Cl)cc1)c1ccccc1.[Cl-]
InChIKey
LFHMDGJKARYXBB-UHFFFAOYSA-N
Molecular formula
C16H19Cl2NO
Average molar mass
312.2 g/mol
Monoisotopic mass
311.0843696

Names & identifiers

Preferred name
Benzyl alcohol, alpha-(1-((p-chlorobenzyl)amino)ethyl)-, hydrochloride
IUPAC
(4-chlorophenyl)methyl-(3-hydroxy-3-phenylpropyl)azanium chloride

Names & synonyms

BS-32alpha-(1-((p-Chlorobenzyl)amino)ethyl)benzyl alcohol hydrochlorideBENZYL ALCOHOL, alpha-(1-((p-CHLOROBENZYL)AMINO)ETHYL)-, HYDROCHLORIDE18864-08-9RefChem:328591

Database identifiers

CAS
18864-08-9
PubChem CID
29312

Properties

Computed structural properties

Topological polar surface area
36.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
20
Formal charge
0
Complexity
235

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Compound notes

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