Name: Name:methyl 2-[(4-bromo-2-nitrophenyl)amino]-2-methylpropanoate
Brand: Angene
SKU: AG01BFH9
Rating: 90 (10 reviews)

methyl 2-[(4-bromo-2-nitrophenyl)amino]-2-methylpropanoate

CAS No.:

1803561-77-4

Catalog Number:

AG01BFH9

Molecular Formula:

C11H13BrN2O4

Molecular Weight:

317.1359

Catalog Number:

AG01BFH9

Chemical Name:

methyl 2-[(4-bromo-2-nitrophenyl)amino]-2-methylpropanoate

CAS Number:

1803561-77-4

Molecular Formula:

C11H13BrN2O4

Molecular Weight:

317.1359

MDL Number:

MFCD28118595

IUPAC Name:

methyl 2-(4-bromo-2-nitroanilino)-2-methylpropanoate

InChI:

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

InChI Key:

JQJJCBSZZGLUIU-UHFFFAOYSA-N

SMILES:

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

Complexity:

330

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:

3.5