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Home > Nitro Compounds > 14748-66-4
14748-66-4 | Naphthalene, 2,3-dimethyl-1,8-dinitro-
CAS No: 14748-66-4 Catalog No: AG001EXE MDL No:
Product Description
Catalog Number:
AG001EXE
Chemical Name:
Naphthalene, 2,3-dimethyl-1,8-dinitro-
CAS Number:
14748-66-4
Molecular Formula:
C12H10N2O4
Molecular Weight:
246.2188
IUPAC Name:
2,3-dimethyl-1,8-dinitronaphthalene
InChI:
InChI=1S/C12H10N2O4/c1-7-6-9-4-3-5-10(13(15)16)11(9)12(8(7)2)14(17)18/h3-6H,1-2H3
InChI Key:
FMVLQWUNRWERKA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)c(C)cc2c1c(ccc2)[N+](=O)[O-]
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.064g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.222g/mol
Monoisotopic Mass:
246.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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