[(3-bromophenyl)methyl](tert-butyl)amine

[(3-bromophenyl)methyl](tert-butyl)amine

CAS: 133042-85-0

Formula: C11H16BrN

SMILES: CC(C)(C)NCC1=CC=CC(Br)=C1

IUPAC: [(3-bromophenyl)methyl](tert-butyl)amine

InChI: InChI=1S/C11H16BrN/c1-11(2,3)13-8-9-5-4-6-10(12)7-9/h4-7,13H,8H2,1-3H3

Composition: C (54.56%), H (6.66%), Br (33.00%), N (5.78%)

Molar Mass: 242.16

Atom Count: 29

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	241.046613
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	WFZPSZJEHGCKDJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.73
Topological Polar Surface Area	12.03
Polarizability	23.74
Ring Count	1
Rotatable Bond Count	3

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