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122246-14-4 | 4,4,6-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo-[3,4-c]quinoline-1-thione
CAS No: 122246-14-4 Catalog No: AG00HGOT MDL No:
Product Description
Catalog Number:
AG00HGOT
Chemical Name:
4,4,6-Trimethyl-4,5-dihydro-1H-[1,2]dithiolo-[3,4-c]quinoline-1-thione
CAS Number:
122246-14-4
IUPAC Name:
4,4,6-trimethyl-5H-dithiolo[3,4-c]quinoline-1-thione
InChI:
InChI=1S/C13H13NS3/c1-7-5-4-6-8-9-11(16-17-12(9)15)13(2,3)14-10(7)8/h4-6,14H,1-3H3
InChI Key:
AQRPGPLODOTTPX-UHFFFAOYSA-N
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.021g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.434g/mol
Monoisotopic Mass:
279.021g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
94.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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