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Home > Aldehydes > 893743-08-3
893743-08-3 | [1,1'-Biphenyl]-3-carboxaldehyde,3'-nitro-
CAS No: 893743-08-3 Catalog No: AG006947 MDL No:
Product Description
Catalog Number:
AG006947
Chemical Name:
[1,1'-Biphenyl]-3-carboxaldehyde,3'-nitro-
CAS Number:
893743-08-3
Molecular Formula:
C13H9NO3
Molecular Weight:
227.2155
IUPAC Name:
3-(3-nitrophenyl)benzaldehyde
InChI:
InChI=1S/C13H9NO3/c15-9-10-3-1-4-11(7-10)12-5-2-6-13(8-12)14(16)17/h1-9H
InChI Key:
LEXUSHONXSYRMN-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.058g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.219g/mol
Monoisotopic Mass:
227.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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