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2,3,4,5-tetrahydro-1H-1-benzazepine hydrochloride

2,3,4,5-tetrahydro-1H-1-benzazepine hydrochloride

CAS: 112610-03-4

Formula: C10H14ClN

SMILES: Cl.C1CCC2=C(NC1)C=CC=C2

IUPAC: 2,3,4,5-tetrahydro-1H-1-benzazepine hydrochloride

InChI: InChI=1S/C10H13N.ClH/c1-2-7-10-9(5-1)6-3-4-8-11-10;/h1-2,5,7,11H,3-4,6,8H2;1H

Composition: C (65.39%), H (7.68%), Cl (19.30%), N (7.63%)

Molar Mass: 183.68

Atom Count: 26

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 183.0814772
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey AESTUMJPPFCEJQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.76
Topological Polar Surface Area 12.03
Polarizability 18.06
Ring Count 2
Rotatable Bond Count 0

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