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4-(methoxymethyl)piperidine - 97%, high purity , CAS No.399580-55-3
Basic Description
Synonyms
4-(methoxymethyl)piperidine | 399580-55-3 | 4-Methoxymethyl-piperidine | MFCD06248041 | Piperidine, 4-(methoxymethyl)- | 4-Methoxymethylpiperidine | SCHEMBL82090 | 4-(methoxy methyl)piperidine | F2145-0240 | 4-(4-methoxy methyl)piperidine | SCHEMBL13088412 | DTXSID20405851 | IHJ
Specifications & Purity
≥97%
Storage Temp
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Piperidines
Alternative Parents
Dialkylamines Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Piperidine - Azacycle - Secondary amine - Ether - Secondary aliphatic amine - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as piperidines. These are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five carbon atoms.
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
Pubchem Sid
504763113
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504763113
IUPAC Name
4-(methoxymethyl)piperidine
INCHI
InChI=1S/C7H15NO/c1-9-6-7-2-4-8-5-3-7/h7-8H,2-6H2,1H3
InChIKey
IHJDIDHHEBJPDL-UHFFFAOYSA-N
Smiles
COCC1CCNCC1
Isomeric SMILES
COCC1CCNCC1
Molecular Weight
129.2001
Reaxy-Rn
103710
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=103710&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Boil Point(°C)
168°C
Melt Point(°C)
60°C
Molecular Weight
129.199 g/mol
XLogP3
0.400
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
129.115 Da
Monoisotopic Mass
129.115 Da
Topological Polar Surface Area
21.300 Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
69.300
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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L2412103