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7145-74-6 | 9H-Fluoren-9-one,1-isocyanato-
CAS No: 7145-74-6 Catalog No: AG005HS7 MDL No:
Product Description
Catalog Number:
AG005HS7
Chemical Name:
9H-Fluoren-9-one,1-isocyanato-
CAS Number:
7145-74-6
Molecular Formula:
C14H7NO2
Molecular Weight:
221.2109
IUPAC Name:
1-isocyanatofluoren-9-one
InChI:
InChI=1S/C14H7NO2/c16-8-15-12-7-3-6-10-9-4-1-2-5-11(9)14(17)13(10)12/h1-7H
InChI Key:
XVVQBWZPPNKESG-UHFFFAOYSA-N
SMILES:
O=C=Nc1cccc2c1C(=O)c1c2cccc1
NSC Number:
74982
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.048g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.215g/mol
Monoisotopic Mass:
221.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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