Home Halogens Benzothiazole, 2-chloro-5-methyl- (7CI,8CI,9CI)

Benzothiazole, 2-chloro-5-methyl- (7CI,8CI,9CI)

CAS No.:
3622-31-9
Catalog Number:
AG00C7C1
Molecular Formula:
C8H6ClNS
Molecular Weight:
183.6579
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00C7C1
Chemical Name:
Benzothiazole, 2-chloro-5-methyl- (7CI,8CI,9CI)
CAS Number:
3622-31-9
Molecular Formula:
C8H6ClNS
Molecular Weight:
183.6579
MDL Number:
MFCD09260926
IUPAC Name:
2-chloro-5-methyl-1,3-benzothiazole
InChI:
InChI=1S/C8H6ClNS/c1-5-2-3-7-6(4-5)10-8(9)11-7/h2-4H,1H3
InChI Key:
LMODYJDUSCQYRS-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc(s2)Cl
Properties
Complexity:
153  
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:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties