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Home > Aldehydes > 103836-27-7
103836-27-7 | 2,3-Naphthalenedicarboxaldehyde, 5-nitro-
CAS No: 103836-27-7 Catalog No: AG007X3I MDL No:
Product Description
Catalog Number:
AG007X3I
Chemical Name:
2,3-Naphthalenedicarboxaldehyde, 5-nitro-
CAS Number:
103836-27-7
Molecular Formula:
C12H7NO4
Molecular Weight:
229.1883
IUPAC Name:
5-nitronaphthalene-2,3-dicarbaldehyde
InChI:
InChI=1S/C12H7NO4/c14-6-9-4-8-2-1-3-12(13(16)17)11(8)5-10(9)7-15/h1-7H
InChI Key:
QPGMESNZJCVKOW-UHFFFAOYSA-N
SMILES:
O=Cc1cc2c(cc1C=O)cccc2[N+](=O)[O-]
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.038g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.191g/mol
Monoisotopic Mass:
229.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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