Home Other Building Blocks 4-CHLORO-2-METHYLPHENYL ISOCYANATE

4-CHLORO-2-METHYLPHENYL ISOCYANATE

CAS No.:
37408-18-7
Catalog Number:
AG003L3V
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$108
- +
5g
98%
In Stock USA
United States
$173
- +
25g
98%
In Stock USA
United States
$371
- +
Product Description
Catalog Number:
AG003L3V
Chemical Name:
4-CHLORO-2-METHYLPHENYL ISOCYANATE
CAS Number:
37408-18-7
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
MDL Number:
MFCD00019914
IUPAC Name:
4-chloro-1-isocyanato-2-methylbenzene
InChI:
InChI=1S/C8H6ClNO/c1-6-4-7(9)2-3-8(6)10-5-11/h2-4H,1H3
InChI Key:
FTZJLXIATZSKIL-UHFFFAOYSA-N
SMILES:
O=C=Nc1ccc(cc1C)Cl
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.014g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.592g/mol
Monoisotopic Mass:
167.014g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties