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51308-60-2 | (4-(1,1-Dimethylethyl)phenyl)methyl heptyl-3-pyridinylcarbonimidodithioate
CAS No: 51308-60-2 Catalog No: AG00DV8C MDL No:
Product Description
Catalog Number:
AG00DV8C
Chemical Name:
(4-(1,1-Dimethylethyl)phenyl)methyl heptyl-3-pyridinylcarbonimidodithioate
CAS Number:
51308-60-2
IUPAC Name:
1-[(4-tert-butylphenyl)methylsulfanyl]-1-heptylsulfanyl-N-pyridin-3-ylmethanimine
InChI:
InChI=1S/C24H34N2S2/c1-5-6-7-8-9-17-27-23(26-22-11-10-16-25-18-22)28-19-20-12-14-21(15-13-20)24(2,3)4/h10-16,18H,5-9,17,19H2,1-4H3
InChI Key:
QXLFSSLRUHROKZ-UHFFFAOYSA-N
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
414.216g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
414.67g/mol
Monoisotopic Mass:
414.216g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.6
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