Name: Name:CarbaMic acid, N-(4-broMo-2-nitrophenyl)-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG00C9KU
Rating: 90 (10 reviews)

CarbaMic acid, N-(4-broMo-2-nitrophenyl)-, 1,1-diMethylethyl ester

CAS No.:

327046-79-7

Catalog Number:

AG00C9KU

Molecular Formula:

C11H13BrN2O4

Molecular Weight:

317.1359

Catalog Number:

AG00C9KU

Chemical Name:

CarbaMic acid, N-(4-broMo-2-nitrophenyl)-, 1,1-diMethylethyl ester

CAS Number:

327046-79-7

Molecular Formula:

C11H13BrN2O4

Molecular Weight:

317.1359

MDL Number:

MFCD20483775

IUPAC Name:

tert-butyl N-(4-bromo-2-nitrophenyl)carbamate

InChI:

InChI=1S/C11H13BrN2O4/c1-11(2,3)18-10(15)13-8-5-4-7(12)6-9(8)14(16)17/h4-6H,1-3H3,(H,13,15)

InChI Key:

VALNWXMPJVPVLQ-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)Nc1ccc(cc1[N+](=O)[O-])Br

Complexity:

324

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

316.006g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

317.139g/mol

Monoisotopic Mass:

316.006g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2