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6889-28-7

6889-28-7 | 3-[(3,4-dichlorobenzyl)sulfanyl]-6-methylpyridazine

CAS No: 6889-28-7 Catalog No: AG006FYK MDL No:

Product Description

Catalog Number:
AG006FYK
Chemical Name:
3-[(3,4-dichlorobenzyl)sulfanyl]-6-methylpyridazine
CAS Number:
6889-28-7
Molecular Formula:
C12H10Cl2N2S
Molecular Weight:
285.1922
IUPAC Name:
3-[(3,4-dichlorophenyl)methylsulfanyl]-6-methylpyridazine
InChI:
InChI=1S/C12H10Cl2N2S/c1-8-2-5-12(16-15-8)17-7-9-3-4-10(13)11(14)6-9/h2-6H,7H2,1H3
InChI Key:
PYFBQIBURCQUSZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(nn1)SCc1ccc(c(c1)Cl)Cl
NSC Number:
66082

Properties

Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.994g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.186g/mol
Monoisotopic Mass:
283.994g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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