Home Halogens Methyl 2-chlorobenzoate

Methyl 2-chlorobenzoate

CAS No.:
610-96-8
Catalog Number:
AG003RNI
Molecular Formula:
C8H7ClO2
Molecular Weight:
170.5930
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10g
95%
In Stock USA
United States
$12
- +
25g
95%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$63
- +
500g
98%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG003RNI
Chemical Name:
Methyl 2-chlorobenzoate
CAS Number:
610-96-8
Molecular Formula:
C8H7ClO2
Molecular Weight:
170.5930
MDL Number:
MFCD00016337
IUPAC Name:
methyl 2-chlorobenzoate
InChI:
InChI=1S/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3
InChI Key:
JAVRNIFMYIJXIE-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccccc1Cl
EC Number:
210-242-0
UNII:
G344NES07R
NSC Number:
7320
Properties
Complexity:
147  
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:
0
Isotope Atom Count:
0
Molecular Weight:
170.592g/mol
Monoisotopic Mass:
170.013g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
2-Chloro-benzohydrazide. Acta crystallographica. Section E, Structure reports online 20120401
Properties