Home Other Building Blocks 2-Hydroxy-4,6-dimethoxybenzoic acid

2-Hydroxy-4,6-dimethoxybenzoic acid

CAS No.:
3187-19-7
Catalog Number:
AG003HEC
Molecular Formula:
C9H10O5
Molecular Weight:
198.1727
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Product Description
Catalog Number:
AG003HEC
Chemical Name:
2-Hydroxy-4,6-dimethoxybenzoic acid
CAS Number:
3187-19-7
Molecular Formula:
C9H10O5
Molecular Weight:
198.1727
MDL Number:
MFCD00013977
IUPAC Name:
2-hydroxy-4,6-dimethoxybenzoic acid
InChI:
InChI=1S/C9H10O5/c1-13-5-3-6(10)8(9(11)12)7(4-5)14-2/h3-4,10H,1-2H3,(H,11,12)
InChI Key:
LEIJLTBRQHFMDL-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc(c1C(=O)O)O
EC Number:
221-683-3
NSC Number:
151975
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.053g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.174g/mol
Monoisotopic Mass:
198.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties