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Home > Nitro Compounds > 15875-61-3
15875-61-3 | 2-[(2-nitrophenyl)methylidene]-2,3-dihydro-1H-indene-1,3-dione
CAS No: 15875-61-3 Catalog No: AG00IV5F MDL No:MFCD00170369
Product Description
Catalog Number:
AG00IV5F
Chemical Name:
2-[(2-nitrophenyl)methylidene]-2,3-dihydro-1H-indene-1,3-dione
CAS Number:
15875-61-3
Molecular Formula:
C16H9NO4
Molecular Weight:
279.2470
MDL Number:
MFCD00170369
IUPAC Name:
2-[(2-nitrophenyl)methylidene]indene-1,3-dione
InChI:
InChI=1S/C16H9NO4/c18-15-11-6-2-3-7-12(11)16(19)13(15)9-10-5-1-4-8-14(10)17(20)21/h1-9H
InChI Key:
LNZCOFHMUCVBOR-UHFFFAOYSA-N
SMILES:
O=C1C(=Cc2ccccc2[N+](=O)[O-])C(=O)c2c1cccc2
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.053g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.251g/mol
Monoisotopic Mass:
279.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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