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5-bromo-2,3-dihydro-1-benzofuran-3-amine hydrochloride

5-bromo-2,3-dihydro-1-benzofuran-3-amine hydrochloride

CAS: 1187927-75-8

Formula: C8H9BrClNO

SMILES: Cl.NC1COC2=CC=C(Br)C=C12

IUPAC: 5-bromo-2,3-dihydro-1-benzofuran-3-amine hydrochloride

InChI: InChI=1/C8H8BrNO.ClH/c9-5-1-2-8-6(3-5)7(10)4-11-8;/h1-3,7H,4,10H2;1H

Composition: C (38.36%), H (3.62%), Br (31.90%), Cl (14.15%), N (5.59%), O (6.39%)

Molar Mass: 250.52

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 248.955605
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey UKCIFENUZLYBRF-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.32
Topological Polar Surface Area 35.25
Polarizability 18.29
Ring Count 2
Rotatable Bond Count 0

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