Home Other Building Blocks 2-Chloro-4-fluoro-3-methylbenzoic acid

2-Chloro-4-fluoro-3-methylbenzoic acid

CAS No.:
173315-54-3
Catalog Number:
AG001YSF
Molecular Formula:
C8H6ClFO2
Molecular Weight:
188.5834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$107
- +
1g
98%
In Stock USA
United States
$269
- +
5g
98%
In Stock USA
United States
$813
- +
Product Description
Catalog Number:
AG001YSF
Chemical Name:
2-Chloro-4-fluoro-3-methylbenzoic acid
CAS Number:
173315-54-3
Molecular Formula:
C8H6ClFO2
Molecular Weight:
188.5834
MDL Number:
MFCD11846444
IUPAC Name:
2-chloro-4-fluoro-3-methylbenzoic acid
InChI:
InChI=1S/C8H6ClFO2/c1-4-6(10)3-2-5(7(4)9)8(11)12/h2-3H,1H3,(H,11,12)
InChI Key:
DBMUFFHLBXKTDM-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1Cl)C)F
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.582g/mol
Monoisotopic Mass:
188.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties