Home Carbonyls 4-Hydroxy-3-(methoxycarbonyl)benzoic acid

4-Hydroxy-3-(methoxycarbonyl)benzoic acid

CAS No.:
41684-11-1
Catalog Number:
AG00CLSI
Molecular Formula:
C9H8O5
Molecular Weight:
196.1568
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$125
- +
1g
96%
In Stock USA
United States
$375
- +
5g
96%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00CLSI
Chemical Name:
4-Hydroxy-3-(methoxycarbonyl)benzoic acid
CAS Number:
41684-11-1
Molecular Formula:
C9H8O5
Molecular Weight:
196.1568
MDL Number:
MFCD11869747
IUPAC Name:
4-hydroxy-3-methoxycarbonylbenzoic acid
InChI:
InChI=1S/C9H8O5/c1-14-9(13)6-4-5(8(11)12)2-3-7(6)10/h2-4,10H,1H3,(H,11,12)
InChI Key:
JDUYMWSYTIJMJO-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(ccc1O)C(=O)O
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.037g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.158g/mol
Monoisotopic Mass:
196.037g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties