5-Fluoro-2-methoxy-3-nitropyridine

CAT: 0127-PC900607-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC900607-01Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1211534-27-8

MDL Number

MFCD18260977

Purity

96%

Smiles

COc1ncc(F)cc1[N+](=O)[O-]

Chemical Information

5-Fluoro-2-methoxy-3-nitropyridine

CAS Number	1211534-27-8
PubChem CID	70699502
IUPAC Name	5-fluoro-2-methoxy-3-nitropyridine
Molecular Formula	C6H5FN2O3
Molecular Weight	172.11
XLogP	1.1
Topological Polar Surface Area	67.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	173

SMILES

COC1=C(C=C(C=N1)F)[N+](=O)[O-]

InChI

InChI=1S/C6H5FN2O3/c1-12-6-5(9(10)11)2-4(7)3-8-6/h2-3H,1H3

InChIKey

AUTWTMWCSZVKJT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1211534-27-8

CID: 70699502

Formula: C6H5FN2O3

MW: 172.11

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	172.11
XLogP3	1.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	172.02842019
Monoisotopic Mass	172.02842019
Topological Polar Surface Area	67.9 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	173
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1261-01	2-Methoxy-5-nitropyridine
OR8579	2-Methoxy-5-methyl-3-nitropyridine
OR31051-01	2-Bromo-5-methoxy-3-nitropyridine
OR345449-01	2-Methoxy-3-methyl-5-nitropyridine
OR345499-01	2-Chloro-5-methoxy-3-nitropyridine
OR8425-01	3-Bromo-2-methoxy-5-nitropyridine
OR902028-01	3-Chloro-2-methoxy-5-nitropyridine
OR43525	2-Hydroxy-3-methoxy-5-nitropyridine
OR345135-01	2-Chloro-3-methoxy-5-nitropyridine
OR11978-01	5-Chloro-2-methoxy-3-nitropyridine

Catalog	Name
418599-01	2-Methoxy-5-nitropyridine
sc-283146A	2-Fluoro-5-nitropyridine
436518-01	5-Fluoro-2-nitropyridine
sc-323450	5-Chloro-2-methoxy-3-nitropyridine
sc-256895A	5-Bromo-2-methoxy-3-nitropyridine
sc-321808	2-Methoxy-5-methyl-3-nitropyridine
263075-01	3-Bromo-2-methoxy-5-nitropyridine
416610-01	2-Chloro-3-methoxy-5-nitropyridine
270334-01	2-Chloro-5-fluoro-3-nitropyridine
abx185958-01	5-Chloro-2-fluoro-3-nitropyridine