2,6-Dimethoxy-3,5-dinitropyridine

CAT: 0127-OR471159Size: 1 EachDry Ice: NoHazardous: No

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CAT#:0127-OR471159Size:1 Each

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CAS Number

18677-42-4

MDL Number

MFCD00955977

Purity

=95%

Smiles

COc1nc(OC)c(cc1[N+](=O)[O-])[N+](=O)[O-]

Chemical Information

2,6-Dimethoxy-3,5-dinitropyridine

CAS Number	18677-42-4
PubChem CID	2784720
IUPAC Name	2,6-dimethoxy-3,5-dinitropyridine
Molecular Formula	C7H7N3O6
Molecular Weight	229.15
XLogP	1.1
Topological Polar Surface Area	123
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	248

SMILES

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

InChI

InChI=1S/C7H7N3O6/c1-15-6-4(9(11)12)3-5(10(13)14)7(8-6)16-2/h3H,1-2H3

InChIKey

SDSANVDGVIOROB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 18677-42-4

CID: 2784720

Formula: C7H7N3O6

MW: 229.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	229.15
XLogP3	1.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	229.03348495
Monoisotopic Mass	229.03348495
Topological Polar Surface Area	123 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	248
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
OR9523-01	2,6-Diamino-3,5-dinitropyridine
OR1037300-01	3,5-Dinitropyridine
OR1004409	2,6-Dinitropyridine
OR1003803-01	3-Chloro-2,6-dinitropyridine
OR5098-01	2-Chloro-3,5-dinitropyridine
OR345540	4-Amino-2-chloro-3,5-dinitropyridine
OR470207	3,5-Dinitropyridine-4-carbonitrile
OR95313-01	4-Amino-3,5-dinitropyridine
OR1086332	5-Chloro-2,6-dimethoxy-3-pyridinecarboxaldehyde
OR1086123	2,6-Dimethoxy-5-methylpyridine-3-carboxaldehyde

Catalog	Name
TRC-D441825-100MG	3,5-Dinitropyridine
416636-01	2-Chloro-3,5-dinitropyridine
sc-230382	2-Hydroxy-3,5-dinitropyridine
C11780-01	2-Chloro-3,5-dinitropyridine 99%
230112-01	2-Chloro-3,5-dinitropyridine 99+% (GC)
76700001	2, Chloro-3,5-Dinitropyridine 99% AR
DEA80842-01	2,5-Dimethoxy-3,4,6-trimethylbenzaldehyde
17691-01	2-Chloro-3,5-Dinitropyridine extrapure AR, 99%
LJB52237-01	3-Bromo-5,6-dimethoxy-2-nitrobenzaldehyde
GTR19182417	5,6-Dimethoxy-2-isopropenylbenzofuran