tert-butyl N-[1-(4-bromophenyl)ethyl]carbamate

tert-butyl N-[1-(4-bromophenyl)ethyl]carbamate

CAS: 850363-42-7

Formula: C13H18BrNO2

SMILES: CC(NC(=O)OC(C)(C)C)C1=CC=C(Br)C=C1

IUPAC: tert-butyl N-[1-(4-bromophenyl)ethyl]carbamate

InChI: InChI=1/C13H18BrNO2/c1-9(10-5-7-11(14)8-6-10)15-12(16)17-13(2,3)4/h5-9H,1-4H3,(H,15,16)

Composition: C (52.01%), H (6.04%), Br (26.62%), N (4.67%), O (10.66%)

Molar Mass: 300.196

Atom Count: 35

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	299.052092
Formal Charge	0
FSP3	0.46
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	KECPRZHCNCDSET-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.45
Topological Polar Surface Area	38.33
Polarizability	27.89
Ring Count	1
Rotatable Bond Count	4

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