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3-(Dimethoxymethyl)-1,5-naphthyridine - 95%, high purity , CAS No.1261365-66-5
Basic Description
Synonyms
3-(Dimethoxymethyl)-1,5-naphthyridine | 1261365-66-5 | DTXSID801280914 | MFCD18374122 | AKOS015851409 | 1,5-Naphthyridine, 3-(dimethoxymethyl)- | CS-0443713 | 3-(Dimethoxymethyl)-1,5-naphthyridine, AldrichCPR
Specifications & Purity
≥95%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Naphthyridines
Intermediate Tree Nodes
Not available
Direct Parent
Naphthyridines
Alternative Parents
Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthyridine - Pyridine - Heteroaromatic compound - Azacycle - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthyridines. These are compounds containing a naphthyridine moiety, a naphthalene in which a carbon atom has been replaced by a nitrogen in each of the two rings. The naphthyridine skeleton can also be described as an assembly two fused pyridine rings, which do not share their nitrogen atom.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
IUPAC Name
3-(dimethoxymethyl)-1,5-naphthyridine
INCHI
InChI=1S/C11H12N2O2/c1-14-11(15-2)8-6-10-9(13-7-8)4-3-5-12-10/h3-7,11H,1-2H3
InChIKey
VOYWQTGTGIDMGG-UHFFFAOYSA-N
Smiles
COC(C1=CC2=C(C=CC=N2)N=C1)OC
Isomeric SMILES
COC(C1=CC2=C(C=CC=N2)N=C1)OC
PubChem CID
50989175
Molecular Weight
204.2
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
204.220 g/mol
XLogP3
0.800
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
204.09 Da
Monoisotopic Mass
204.09 Da
Topological Polar Surface Area
44.200 Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
197.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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