200,000+ products from a single source!
sales@angenechem.com
1149386-07-1 | Benzoic acid, 4-(aminocarbonyl)-3-bromo-
CAS No: 1149386-07-1 Catalog No: AG000FH0 MDL No:MFCD23135695
Product Description
Catalog Number:
AG000FH0
Chemical Name:
Benzoic acid, 4-(aminocarbonyl)-3-bromo-
CAS Number:
1149386-07-1
Molecular Formula:
C8H6BrNO3
Molecular Weight:
244.0421
MDL Number:
MFCD23135695
IUPAC Name:
3-bromo-4-carbamoylbenzoic acid
InChI:
InChI=1S/C8H6BrNO3/c9-6-3-4(8(12)13)1-2-5(6)7(10)11/h1-3H,(H2,10,11)(H,12,13)
InChI Key:
HMRFNAGNNSZCGO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)Br)C(=O)N
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.953g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
244.044g/mol
Monoisotopic Mass:
242.953g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.