Home Carboxys 2'-(Hydroxymethyl)biphenyl-3-carboxylic acid

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

CAS No.:
773872-29-0
Catalog Number:
AG005BKM
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$188
- +
5g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG005BKM
Chemical Name:
2'-(Hydroxymethyl)biphenyl-3-carboxylic acid
CAS Number:
773872-29-0
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
MDL Number:
MFCD06203047
IUPAC Name:
3-[2-(hydroxymethyl)phenyl]benzoic acid
InChI:
InChI=1S/C14H12O3/c15-9-12-4-1-2-7-13(12)10-5-3-6-11(8-10)14(16)17/h1-8,15H,9H2,(H,16,17)
InChI Key:
LIUSEGRHRKNETK-UHFFFAOYSA-N
SMILES:
OCc1ccccc1c1cccc(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