Name: Name:Carbamic acid, [4-(bromoacetyl)phenyl]-, phenylmethyl ester (9CI)
Brand: Angene
SKU: AG001P59
Rating: 90 (10 reviews)

Carbamic acid, [4-(bromoacetyl)phenyl]-, phenylmethyl ester (9CI)

CAS No.:

157014-41-0

Catalog Number:

AG001P59

Molecular Formula:

C16H14BrNO3

Molecular Weight:

348.1913

Catalog Number:

AG001P59

Chemical Name:

Carbamic acid, [4-(bromoacetyl)phenyl]-, phenylmethyl ester (9CI)

CAS Number:

157014-41-0

Molecular Formula:

C16H14BrNO3

Molecular Weight:

348.1913

MDL Number:

MFCD05663954

IUPAC Name:

benzyl N-[4-(2-bromoacetyl)phenyl]carbamate

InChI:

InChI=1S/C16H14BrNO3/c17-10-15(19)13-6-8-14(9-7-13)18-16(20)21-11-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,18,20)

InChI Key:

SGOOUOYLZRYRQG-UHFFFAOYSA-N

SMILES:

BrCC(=O)c1ccc(cc1)NC(=O)OCc1ccccc1

Complexity:

347

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

347.016g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

348.196g/mol

Monoisotopic Mass:

347.016g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5