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Home Other Building Blocks 2,5-Dimethylbenzoic acid

2,5-Dimethylbenzoic acid

CAS No.:
610-72-0
Catalog Number:
AG003FZQ
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$15
- +
25g
98%
In Stock USA
United States
$35
- +
100g
98%
In Stock USA
United States
$107
- +
500g
98%
In Stock USA
United States
$338
- +
Product Description
Catalog Number:
AG003FZQ
Chemical Name:
2,5-Dimethylbenzoic acid
CAS Number:
610-72-0
Molecular Formula:
C9H10O2
Molecular Weight:
150.1745
MDL Number:
MFCD00002482
IUPAC Name:
2,5-dimethylbenzoic acid
InChI:
InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChI Key:
XZRHNAFEYMSXRG-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C(=O)O)C
EC Number:
210-235-2
UNII:
RKE5PMK0H6
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:
2.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Toxicokinetics and metabolism of pseudocumene (1,2,4-trimethylbenzene) after inhalation exposure in rats. International journal of occupational medicine and environmental health 20020101
Properties