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89080-93-3 | 2(1H)-Quinolinone, 4-methyl-3-(3-thienyl)-
CAS No: 89080-93-3 Catalog No: AG003ZP8 MDL No:
Product Description
Catalog Number:
AG003ZP8
Chemical Name:
2(1H)-Quinolinone, 4-methyl-3-(3-thienyl)-
CAS Number:
89080-93-3
Molecular Formula:
C14H11NOS
Molecular Weight:
241.3082
IUPAC Name:
4-methyl-3-thiophen-3-yl-1H-quinolin-2-one
InChI:
InChI=1S/C14H11NOS/c1-9-11-4-2-3-5-12(11)15-14(16)13(9)10-6-7-17-8-10/h2-8H,1H3,(H,15,16)
InChI Key:
INARPRPNEFFJFE-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2ccccc2c(c1c1cscc1)C
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.308g/mol
Monoisotopic Mass:
241.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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