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3916-78-7 | 6-Chloro-3(2H)-pyridazinethione
CAS No: 3916-78-7 Catalog No: AG0037WR MDL No:MFCD08691217
Product Description
Catalog Number:
AG0037WR
Chemical Name:
6-Chloro-3(2H)-pyridazinethione
CAS Number:
3916-78-7
Molecular Formula:
C4H3ClN2S
Molecular Weight:
146.5980
MDL Number:
MFCD08691217
IUPAC Name:
3-chloro-1H-pyridazine-6-thione
InChI:
InChI=1S/C4H3ClN2S/c5-3-1-2-4(8)7-6-3/h1-2H,(H,7,8)
InChI Key:
ABQHEWLZYZQXHY-UHFFFAOYSA-N
SMILES:
Clc1ccc(=S)[nH]n1
NSC Number:
75790
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.971g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.592g/mol
Monoisotopic Mass:
145.971g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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