Home Other Building Blocks 4-Bromo-2-formylbenzoic acid

4-Bromo-2-formylbenzoic acid

CAS No.:
871502-87-3
Catalog Number:
AG00367A
Molecular Formula:
C8H5BrO3
Molecular Weight:
229.0275
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$157
- +
1g
95%
1 week
United States
$337
- +
Product Description
Catalog Number:
AG00367A
Chemical Name:
4-Bromo-2-formylbenzoic acid
CAS Number:
871502-87-3
Molecular Formula:
C8H5BrO3
Molecular Weight:
229.0275
MDL Number:
MFCD11036374
IUPAC Name:
4-bromo-2-formylbenzoic acid
InChI:
InChI=1S/C8H5BrO3/c9-6-1-2-7(8(11)12)5(3-6)4-10/h1-4H,(H,11,12)
InChI Key:
GHVFFWJIPXPVBE-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Br)ccc1C(=O)O
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.942g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.029g/mol
Monoisotopic Mass:
227.942g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties