[(3-bromophenyl)methyl](butyl)methylamine

[(3-bromophenyl)methyl](butyl)methylamine

CAS: 1119452-28-6

Formula: C12H18BrN

SMILES: CCCCN(C)CC1=CC(Br)=CC=C1

IUPAC: [(3-bromophenyl)methyl](butyl)methylamine

InChI: InChI=1S/C12H18BrN/c1-3-4-8-14(2)10-11-6-5-7-12(13)9-11/h5-7,9H,3-4,8,10H2,1-2H3

Composition: C (56.26%), H (7.08%), Br (31.19%), N (5.47%)

Molar Mass: 256.187

Atom Count: 32

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	255.062263
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	CGNNNVNRCBGRLE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.1
Topological Polar Surface Area	3.24
Polarizability	25.57
Ring Count	1
Rotatable Bond Count	5

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