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Home > Pyridines > 2060063-31-0
2060063-31-0 | 2-tert-butyl-5-methyl-2,3-dihydropyridazine-3-thione
CAS No: 2060063-31-0 Catalog No: AG01BS2U MDL No:MFCD30502612
Product Description
Catalog Number:
AG01BS2U
Chemical Name:
2-tert-butyl-5-methyl-2,3-dihydropyridazine-3-thione
CAS Number:
2060063-31-0
Molecular Formula:
C9H14N2S
Molecular Weight:
182.2859
MDL Number:
MFCD30502612
IUPAC Name:
2-tert-butyl-5-methylpyridazine-3-thione
InChI:
InChI=1S/C9H14N2S/c1-7-5-8(12)11(10-6-7)9(2,3)4/h5-6H,1-4H3
InChI Key:
JHFPVOJFYJDIEQ-UHFFFAOYSA-N
SMILES:
Cc1cnn(c(=S)c1)C(C)(C)C
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.088g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.285g/mol
Monoisotopic Mass:
182.088g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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