1-(4-bromophenyl)piperidin-4-one

1-(4-bromophenyl)piperidin-4-one

CAS: 154913-23-2

Formula: C11H12BrNO

SMILES: BrC1=CC=C(C=C1)N1CCC(=O)CC1

IUPAC: 1-(4-bromophenyl)piperidin-4-one

InChI: InChI=1S/C11H12BrNO/c12-9-1-3-10(4-2-9)13-7-5-11(14)6-8-13/h1-4H,5-8H2

Composition: C (51.99%), H (4.76%), Br (31.44%), N (5.51%), O (6.30%)

Molar Mass: 254.127

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	253.010227
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FBZGTFCMSGXCRE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.58
Topological Polar Surface Area	20.31
Polarizability	22.8
Ring Count	2
Rotatable Bond Count	1

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