Home Halogens 2(3H)-Benzothiazolone,6-chloro-4-methyl-,hydrazone(9CI)

2(3H)-Benzothiazolone,6-chloro-4-methyl-,hydrazone(9CI)

CAS No.:
80945-75-1
Catalog Number:
AG00GQV4
Molecular Formula:
C8H8ClN3S
Molecular Weight:
213.6872
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Product Description
Catalog Number:
AG00GQV4
Chemical Name:
2(3H)-Benzothiazolone,6-chloro-4-methyl-,hydrazone(9CI)
CAS Number:
80945-75-1
Molecular Formula:
C8H8ClN3S
Molecular Weight:
213.6872
MDL Number:
MFCD17178558
IUPAC Name:
(6-chloro-4-methyl-1,3-benzothiazol-2-yl)hydrazine
InChI:
InChI=1S/C8H8ClN3S/c1-4-2-5(9)3-6-7(4)11-8(12-10)13-6/h2-3H,10H2,1H3,(H,11,12)
InChI Key:
CZVUVHRYOAEHAJ-UHFFFAOYSA-N
SMILES:
NN=c1sc2c([nH]1)c(C)cc(c2)Cl
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.013g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
213.683g/mol
Monoisotopic Mass:
213.013g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
79.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties