Home Halogens Benzoic acid,3-chloro-2,6-dihydroxy-

Benzoic acid,3-chloro-2,6-dihydroxy-

CAS No.:
26754-77-8
Catalog Number:
AG007KQH
Molecular Formula:
C7H5ClO4
Molecular Weight:
188.5652
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Product Description
Catalog Number:
AG007KQH
Chemical Name:
Benzoic acid,3-chloro-2,6-dihydroxy-
CAS Number:
26754-77-8
Molecular Formula:
C7H5ClO4
Molecular Weight:
188.5652
MDL Number:
MFCD03788831
IUPAC Name:
3-chloro-2,6-dihydroxybenzoic acid
InChI:
InChI=1S/C7H5ClO4/c8-3-1-2-4(9)5(6(3)10)7(11)12/h1-2,9-10H,(H,11,12)
InChI Key:
DSGFVWJTKIEIDU-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(O)ccc(c1O)Cl
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.988g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
188.563g/mol
Monoisotopic Mass:
187.988g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties