Home Other Building Blocks 2-Chloro-6-methylbenzoic acid

2-Chloro-6-methylbenzoic acid

CAS No.:
21327-86-6
Catalog Number:
AG003H0T
Molecular Formula:
C8H7ClO2
Molecular Weight:
170.5930
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$38
- +
25g
98%
In Stock USA
United States
$138
- +
100g
98%
In Stock USA
United States
$475
- +
Product Description
Catalog Number:
AG003H0T
Chemical Name:
2-Chloro-6-methylbenzoic acid
CAS Number:
21327-86-6
Molecular Formula:
C8H7ClO2
Molecular Weight:
170.5930
MDL Number:
MFCD00045799
IUPAC Name:
2-chloro-6-methylbenzoic acid
InChI:
InChI=1S/C8H7ClO2/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,1H3,(H,10,11)
InChI Key:
CEFMMQYDPGCYMG-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(C)cccc1Cl
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.013g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.592g/mol
Monoisotopic Mass:
170.013g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties