Home Other Building Blocks 3-Methyl-4-phenylbenzoic acid

3-Methyl-4-phenylbenzoic acid

CAS No.:
178313-67-2
Catalog Number:
AG0025X0
Molecular Formula:
C14H12O2
Molecular Weight:
212.2439
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG0025X0
Chemical Name:
3-Methyl-4-phenylbenzoic acid
CAS Number:
178313-67-2
Molecular Formula:
C14H12O2
Molecular Weight:
212.2439
MDL Number:
MFCD11554176
IUPAC Name:
3-methyl-4-phenylbenzoic acid
InChI:
InChI=1S/C14H12O2/c1-10-9-12(14(15)16)7-8-13(10)11-5-3-2-4-6-11/h2-9H,1H3,(H,15,16)
InChI Key:
ITLWSYAJGXPQSO-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1c1ccccc1)C(=O)O
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.084g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.248g/mol
Monoisotopic Mass:
212.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties