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Home > Indoles and Oxindole > 1190318-99-0
1190318-99-0 | 2H-Indol-2-one, 1,3-dihydro-3-hydroxy-5-nitro-3-phenyl-
CAS No: 1190318-99-0 Catalog No: AG000HU8 MDL No:
Product Description
Catalog Number:
AG000HU8
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3-hydroxy-5-nitro-3-phenyl-
CAS Number:
1190318-99-0
Molecular Formula:
C14H10N2O4
Molecular Weight:
270.2402
IUPAC Name:
3-hydroxy-5-nitro-3-phenyl-1H-indol-2-one
InChI:
InChI=1S/C14H10N2O4/c17-13-14(18,9-4-2-1-3-5-9)11-8-10(16(19)20)6-7-12(11)15-13/h1-8,18H,(H,15,17)
InChI Key:
HCKJFCXAHQCCPD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)C(O)(c1ccccc1)C(=O)N2
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.064g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
270.244g/mol
Monoisotopic Mass:
270.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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