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73428-05-4 | 2-Naphthalenecarboxaldehyde,3-nitro-
CAS No: 73428-05-4 Catalog No: AG005E0R MDL No:
Product Description
Catalog Number:
AG005E0R
Chemical Name:
2-Naphthalenecarboxaldehyde,3-nitro-
CAS Number:
73428-05-4
Molecular Formula:
C11H7NO3
Molecular Weight:
201.1782
IUPAC Name:
3-nitronaphthalene-2-carbaldehyde
InChI:
InChI=1S/C11H7NO3/c13-7-10-5-8-3-1-2-4-9(8)6-11(10)12(14)15/h1-7H
InChI Key:
SMFXJXWPJBCOHC-UHFFFAOYSA-N
SMILES:
O=Cc1cc2ccccc2cc1[N+](=O)[O-]
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.043g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.181g/mol
Monoisotopic Mass:
201.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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