tert-butyl N,N-bis(2-bromoethyl)carbamate

tert-butyl N,N-bis(2-bromoethyl)carbamate

CAS: 159635-50-4

Formula: C9H17Br2NO2

SMILES: CC(C)(C)OC(=O)N(CCBr)CCBr

IUPAC: tert-butyl N,N-bis(2-bromoethyl)carbamate

InChI: InChI=1S/C9H17Br2NO2/c1-9(2,3)14-8(13)12(6-4-10)7-5-11/h4-7H2,1-3H3

Composition: C (32.65%), H (5.18%), Br (48.27%), N (4.23%), O (9.67%)

Molar Mass: 331.048

Atom Count: 31

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	328.962605
Formal Charge	0
FSP3	0.89
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	CIKNCWSDHQVBKL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.34
Topological Polar Surface Area	29.54
Polarizability	24.98
Ring Count	0
Rotatable Bond Count	6

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