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16233-09-3 | 9H-Fluoren-9-one, 2-amino-3-(methylthio)-
CAS No: 16233-09-3 Catalog No: AG001T0O MDL No:
Product Description
Catalog Number:
AG001T0O
Chemical Name:
9H-Fluoren-9-one, 2-amino-3-(methylthio)-
CAS Number:
16233-09-3
Molecular Formula:
C14H11NOS
Molecular Weight:
241.3082
IUPAC Name:
2-amino-3-methylsulfanylfluoren-9-one
InChI:
InChI=1S/C14H11NOS/c1-17-13-7-10-8-4-2-3-5-9(8)14(16)11(10)6-12(13)15/h2-7H,15H2,1H3
InChI Key:
FXTICZWWMJXJNO-UHFFFAOYSA-N
SMILES:
CSc1cc2c3ccccc3C(=O)c2cc1N
NSC Number:
109634
Properties
Complexity:
319
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:
3
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:
68.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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