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2-Methyl-4-nitropyridine

CAT: 0572-TRC-M325625-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M325625-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
13508-96-8
Hazard Statement
No Data Available
Smiles
Cc1cc(ccn1)[N+](=O)[O-]
Molecular Formula
C6 H6 N2 O2
Molecular Weight
138.12
InChI
InChI=1S/C6H6N2O2/c1-5-4-6(8(9)10)2-3-7-5/h2-4H,1H3
Additionnal Information
IUPAC name: 2-methyl-4-nitropyridine
Shipping Conditions
Room Temperature

Chemical Information

Pyridine, 2-methyl-4-nitro-
CAS Number13508-96-8
PubChem CID98849
IUPAC Name2-methyl-4-nitropyridine
Molecular FormulaC6H6N2O2
Molecular Weight138.12
XLogP0.9
Topological Polar Surface Area58.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity132
SMILES
CC1=NC=CC(=C1)[N+](=O)[O-]
InChI
InChI=1S/C6H6N2O2/c1-5-4-6(8(9)10)2-3-7-5/h2-4H,1H3
InChIKey
HWPIDHRDNNZJSY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyridine, 2-methyl-4-nitro-
CAS: 13508-96-8
CID: 98849
Formula: C6H6N2O2
MW: 138.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight138.12
XLogP30.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass138.042927438
Monoisotopic Mass138.042927438
Topological Polar Surface Area58.7 Ų
Heavy Atom Count10
Formal Charge0
Complexity132
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
233335-014-Methyl-2-nitropyridine
sc-2600122-Methyl-4-nitropyridine
GYB24995-01Methyl 6-methyl-4-nitropyridine-2-carboxylate
OR93852-01Methyl 4-methyl-5-nitropyridine-2-carboxylate
FC20099-012-Chloro-4-methyl-3-nitropyridine
GJB83465-014-Chloro-2-methyl-5-nitropyridine
EDA05551-012-Chloro-6-methyl-4-nitropyridine
DFC87337-015-Bromo-2-methyl-4-nitropyridine
DFC82544-014-Methyl-3-nitropyridine-2-carbonitrile
AZB27870-015-Bromo-4-methyl-2-nitropyridine

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