Home Carboxys 3'-(Hydroxymethyl)biphenyl-3-carboxylic acid

3'-(Hydroxymethyl)biphenyl-3-carboxylic acid

CAS No.:
176212-48-9
Catalog Number:
AG0024HA
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG0024HA
Chemical Name:
3'-(Hydroxymethyl)biphenyl-3-carboxylic acid
CAS Number:
176212-48-9
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
MDL Number:
MFCD06203070
IUPAC Name:
3-[3-(hydroxymethyl)phenyl]benzoic acid
InChI:
InChI=1S/C14H12O3/c15-9-10-3-1-4-11(7-10)12-5-2-6-13(8-12)14(16)17/h1-8,15H,9H2,(H,16,17)
InChI Key:
SWVDMIKPVOEKNC-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1)c1cccc(c1)C(=O)O
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.079g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
228.247g/mol
Monoisotopic Mass:
228.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties