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Home Other Building Blocks 2-(4-Methylphenyl)propanoic acid

2-(4-Methylphenyl)propanoic acid

CAS No.:
938-94-3
Catalog Number:
AG003EX6
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
98%
In Stock USA
United States
$32
- +
100g
98%
In Stock USA
United States
$100
- +
500g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG003EX6
Chemical Name:
2-(4-Methylphenyl)propanoic acid
CAS Number:
938-94-3
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD01111378
IUPAC Name:
2-(4-methylphenyl)propanoic acid
InChI:
InChI=1S/C10H12O2/c1-7-3-5-9(6-4-7)8(2)10(11)12/h3-6,8H,1-2H3,(H,11,12)
InChI Key:
KDYOFXPLHVSIHS-UHFFFAOYSA-N
SMILES:
C[C@H](c1ccc(cc1)C)C(=O)O
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
2-Arylpropionic CXC chemokine receptor 1 (CXCR1) ligands as novel noncompetitive CXCL8 inhibitors. Journal of medicinal chemistry 20050630
Properties