200,000+ products from a single source!
sales@angenechem.com
157014-41-0 | Carbamic acid, [4-(bromoacetyl)phenyl]-, phenylmethyl ester (9CI)
CAS No: 157014-41-0 Catalog No: AG001P59 MDL No:MFCD05663954
Product Description
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
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.016g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
348.196g/mol
Monoisotopic Mass:
347.016g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.