Home Halogens 3-Bromo-5-chloro salicylic acid

3-Bromo-5-chloro salicylic acid

CAS No.:
4068-58-0
Catalog Number:
AG00CRIO
Molecular Formula:
C7H4BrClO3
Molecular Weight:
251.4619
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Product Description
Catalog Number:
AG00CRIO
Chemical Name:
3-Bromo-5-chloro salicylic acid
CAS Number:
4068-58-0
Molecular Formula:
C7H4BrClO3
Molecular Weight:
251.4619
MDL Number:
MFCD00985201
IUPAC Name:
3-bromo-5-chloro-2-hydroxybenzoic acid
InChI:
InChI=1S/C7H4BrClO3/c8-5-2-3(9)1-4(6(5)10)7(11)12/h1-2,10H,(H,11,12)
InChI Key:
XDHJZXVJIHAQIU-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c(c(c1)C(=O)O)O
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.903g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
251.46g/mol
Monoisotopic Mass:
249.903g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties