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3H-1-Benzazepin-2-amine, 4,5-dihydro-N-(2-methylpropyl)-, monohydrochloride

HCID 59237
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Basic information

CAS
102147-13-7
Standard SMILES
CC(C)C[NH2+]C1=Nc2ccccc2CCC1.[Cl-]
InChIKey
VSFGOWMWMSKPRL-UHFFFAOYSA-N
Molecular formula
C14H21ClN2
Average molar mass
252.78 g/mol
Monoisotopic mass
252.1393264

Names & identifiers

Preferred name
3H-1-Benzazepin-2-amine, 4,5-dihydro-N-(2-methylpropyl)-, monohydrochloride
IUPAC
4,5-dihydro-3H-1-benzazepin-2-yl(2-methylpropyl)azanium chloride

Names & synonyms

3H-1-BENZAZEPIN-2-AMINE, 4,5-DIHYDRO-N-(2-METHYLPROPYL)-, MONOHYDROCHLORIDE102147-13-7RefChem:10689194,5-Dihydro-N-(2-methylpropyl)-3H-1-benzazepin-2-amine hydrochloride

Database identifiers

CAS
102147-13-7
PubChem CID
59237

Properties

Computed structural properties

Topological polar surface area
29 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
245

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