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Home Other Building Blocks 3,4-Dimethylbenzoic acid

3,4-Dimethylbenzoic acid

CAS No.:
619-04-5
Catalog Number:
AG0033IS
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$50
- +
100g
98%(HPLC)
In Stock USA
United States
$150
- +
250g
98%(HPLC)
In Stock USA
United States
$298
- +
Product Description
Catalog Number:
AG0033IS
Chemical Name:
3,4-Dimethylbenzoic acid
CAS Number:
619-04-5
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD00002524
IUPAC Name:
3,4-dimethylbenzoic acid
InChI:
InChI=1S/C9H10O2/c1-6-3-4-8(9(10)11)5-7(6)2/h3-5H,1-2H3,(H,10,11)
InChI Key:
OPVAJFQBSDUNQA-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)C)C
EC Number:
210-576-7
UNII:
Z2TCZ088AV
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.068g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
150.177g/mol
Monoisotopic Mass:
150.068g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Small-angle neutron scattering study of shearing effects on drag-reducing surfactant solutions. Journal of colloid and interface science 20090901
Use of the two-liquid phase concept to exploit kinetically controlled multistep biocatalysis. Biotechnology and bioengineering 20030320
An improved synthesis of 5,6-dimethylxanthenone-4-acetic acid (DMXAA). European journal of medicinal chemistry 20021001
Toxicokinetics and metabolism of pseudocumene (1,2,4-trimethylbenzene) after inhalation exposure in rats. International journal of occupational medicine and environmental health 20020101
Properties