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742060-73-7 | Quinoline, 4-isothiocyanato-2-methyl- (9CI)
CAS No: 742060-73-7 Catalog No: AG00FYWI MDL No:
Product Description
Catalog Number:
AG00FYWI
Chemical Name:
Quinoline, 4-isothiocyanato-2-methyl- (9CI)
CAS Number:
742060-73-7
IUPAC Name:
4-isothiocyanato-2-methylquinoline
InChI:
InChI=1S/C11H8N2S/c1-8-6-11(12-7-14)9-4-2-3-5-10(9)13-8/h2-6H,1H3
InChI Key:
KQTUIFFCRDJLDF-UHFFFAOYSA-N
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.041g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.259g/mol
Monoisotopic Mass:
200.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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