Home Other Building Blocks 2-Chlorobenzyl thiocyanate

2-Chlorobenzyl thiocyanate

CAS No.:
2082-66-8
Catalog Number:
AG002JKK
Molecular Formula:
C8H6ClNS
Molecular Weight:
183.6579
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$63
- +
1g
1 week
United States
$88
- +
Product Description
Catalog Number:
AG002JKK
Chemical Name:
2-Chlorobenzyl thiocyanate
CAS Number:
2082-66-8
Molecular Formula:
C8H6ClNS
Molecular Weight:
183.6579
MDL Number:
MFCD09025671
IUPAC Name:
(2-chlorophenyl)methyl thiocyanate
InChI:
InChI=1S/C8H6ClNS/c9-8-4-2-1-3-7(8)5-11-6-10/h1-4H,5H2
InChI Key:
BEQHMRYBIXNFTP-UHFFFAOYSA-N
SMILES:
N#CSCc1ccccc1Cl
NSC Number:
145803
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.991g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.653g/mol
Monoisotopic Mass:
182.991g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties