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Home > Nitro Compounds > 119694-70-1
119694-70-1 | Pyridine, 2-(1,3-dioxolan-2-yl)-4-methyl-5-nitro-
CAS No: 119694-70-1 Catalog No: AG000PGA MDL No:
Product Description
Catalog Number:
AG000PGA
Chemical Name:
Pyridine, 2-(1,3-dioxolan-2-yl)-4-methyl-5-nitro-
CAS Number:
119694-70-1
Molecular Formula:
C9H10N2O4
Molecular Weight:
210.1867
IUPAC Name:
2-(1,3-dioxolan-2-yl)-4-methyl-5-nitropyridine
InChI:
InChI=1S/C9H10N2O4/c1-6-4-7(9-14-2-3-15-9)10-5-8(6)11(12)13/h4-5,9H,2-3H2,1H3
InChI Key:
MRUJSTYNKVSMNY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(cc1C)C1OCCO1
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.064g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.189g/mol
Monoisotopic Mass:
210.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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