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Home Other Building Blocks 2-Methyl-2-phenylpropionic acid

2-Methyl-2-phenylpropionic acid

CAS No.:
826-55-1
Catalog Number:
AG003HM4
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$25
- +
100g
98%
In Stock USA
United States
$63
- +
500g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG003HM4
Chemical Name:
2-Methyl-2-phenylpropionic acid
CAS Number:
826-55-1
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD00014332
IUPAC Name:
2-methyl-2-phenylpropanoic acid
InChI:
InChI=1S/C10H12O2/c1-10(2,9(11)12)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12)
InChI Key:
YYEROYLAYAVZNW-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccccc1)(C)C
EC Number:
212-556-3
UNII:
DR8HUH2GYK
Properties
Complexity:
167  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
High-performance liquid chromatography/mass spectrometric and proton nuclear magnetic resonance spectroscopic studies of the transacylation and hydrolysis of the acyl glucuronides of a series of phenylacetic acids in buffer and human plasma. Rapid communications in mass spectrometry : RCM 20101030
Properties