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88322-67-2 | 2H-Thiopyrano[2,3-b]quinoline, 3,4-dihydro-2,5-dimethyl-
CAS No: 88322-67-2 Catalog No: AG0089WV MDL No:
Product Description
Catalog Number:
AG0089WV
Chemical Name:
2H-Thiopyrano[2,3-b]quinoline, 3,4-dihydro-2,5-dimethyl-
CAS Number:
88322-67-2
Molecular Formula:
C14H15NS
Molecular Weight:
229.3406
IUPAC Name:
2,5-dimethyl-3,4-dihydro-2H-thiopyrano[2,3-b]quinoline
InChI:
InChI=1S/C14H15NS/c1-9-7-8-12-10(2)11-5-3-4-6-13(11)15-14(12)16-9/h3-6,9H,7-8H2,1-2H3
InChI Key:
AFBCWLINLSTRHK-UHFFFAOYSA-N
SMILES:
CC1CCc2c(S1)nc1c(c2C)cccc1
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.093g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.341g/mol
Monoisotopic Mass:
229.093g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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