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51308-52-2 | (4-(1,1-Dimethylethyl)phenyl)methyl methyl-3-pyridinylcarbonimidodithioate
CAS No: 51308-52-2 Catalog No: AG00DVBO MDL No:
Product Description
Catalog Number:
AG00DVBO
Chemical Name:
(4-(1,1-Dimethylethyl)phenyl)methyl methyl-3-pyridinylcarbonimidodithioate
CAS Number:
51308-52-2
IUPAC Name:
1-[(4-tert-butylphenyl)methylsulfanyl]-1-methylsulfanyl-N-pyridin-3-ylmethanimine
InChI:
InChI=1S/C18H22N2S2/c1-18(2,3)15-9-7-14(8-10-15)13-22-17(21-4)20-16-6-5-11-19-12-16/h5-12H,13H2,1-4H3
InChI Key:
FROZCKGNRZGBMQ-UHFFFAOYSA-N
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.122g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.508g/mol
Monoisotopic Mass:
330.122g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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