Home Carboxys Chroman-4-carboxylic acid

Chroman-4-carboxylic acid

CAS No.:
20426-80-6
Catalog Number:
AG0029E5
Molecular Formula:
C10H10O3
Molecular Weight:
178.1846
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$339
- +
Product Description
Catalog Number:
AG0029E5
Chemical Name:
Chroman-4-carboxylic acid
CAS Number:
20426-80-6
Molecular Formula:
C10H10O3
Molecular Weight:
178.1846
MDL Number:
MFCD11848749
IUPAC Name:
3,4-dihydro-2H-chromene-4-carboxylic acid
InChI:
InChI=1S/C10H10O3/c11-10(12)8-5-6-13-9-4-2-1-3-7(8)9/h1-4,8H,5-6H2,(H,11,12)
InChI Key:
RGWHTTALQBHDGZ-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCOc2c1cccc2
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.063g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.187g/mol
Monoisotopic Mass:
178.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties