Home Other Building Blocks 2-Chloro-4,5-dimethylbenzoic acid

2-Chloro-4,5-dimethylbenzoic acid

CAS No.:
15089-74-4
Catalog Number:
AG01A2BA
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$239
- +
1g
98%
1 week
United States
$448
- +
5g
98%
1 week
United States
$1281
- +
25g
98%
1 week
United States
$2712
- +
Product Description
Catalog Number:
AG01A2BA
Chemical Name:
2-Chloro-4,5-dimethylbenzoic acid
CAS Number:
15089-74-4
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD16817648
IUPAC Name:
2-chloro-4,5-dimethylbenzoic acid
InChI:
InChI=1S/C9H9ClO2/c1-5-3-7(9(11)12)8(10)4-6(5)2/h3-4H,1-2H3,(H,11,12)
InChI Key:
XBZNOTXVXOPTJB-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(C)c(cc1Cl)C
NSC Number:
409552
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties