Home Other Building Blocks o-methoxybenzenesulphinic acid

o-methoxybenzenesulphinic acid

CAS No.:
13165-78-1
Catalog Number:
AG00AJ6E
Molecular Formula:
C7H8O3S
Molecular Weight:
172.2016
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Product Description
Catalog Number:
AG00AJ6E
Chemical Name:
o-methoxybenzenesulphinic acid
CAS Number:
13165-78-1
Molecular Formula:
C7H8O3S
Molecular Weight:
172.2016
MDL Number:
MFCD21910066
IUPAC Name:
2-methoxybenzenesulfinic acid
InChI:
InChI=1S/C7H8O3S/c1-10-6-4-2-3-5-7(6)11(8)9/h2-5H,1H3,(H,8,9)
InChI Key:
FLEOBKHAPXSNGY-UHFFFAOYSA-N
SMILES:
COc1ccccc1S(=O)O
EC Number:
236-107-6
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.019g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.198g/mol
Monoisotopic Mass:
172.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
65.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties