3,5-Dimethylpiperidine, mixture of cis and trans - CAS 35794-11-7

Catalog:	BB022760
Product Name:	3,5-Dimethylpiperidine, mixture of cis and trans
CAS:	35794-11-7
Synonyms:	3,5-dimethylpiperidine

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Computed Properties

IUPAC Name:	3,5-dimethylpiperidine
Description:	3,5-Dimethylpiperidine, mixture of cis and trans (CAS# 35794-11-7) is a useful research chemical.
Molecular Weight:	113.20
Molecular Formula:	C7H15N
Canonical SMILES:	CC1CC(CNC1)C
InChI:	InChI=1S/C7H15N/c1-6-3-7(2)5-8-4-6/h6-8H,3-5H2,1-2H3
InChI Key:	IDWRJRPUIXRFRX-UHFFFAOYSA-N
Boiling Point:	144 ℃
Purity:	98 %
Density:	0.853 g/cm³
Appearance:	Colorless liquid
Storage:	Flammables area
MDL:	MFCD00005996
LogP:	1.58070

Publication Number	Title	Priority Date
CN-113429827-A	Preparation method of environment-friendly nano ink	20210622
CN-113372262-A	Preparation method of trans-3, 5-dimethylpiperidine	20210608
JP-2021080483-A	Complex	20210304
CN-112844452-A	Modified molecular sieve, preparation method thereof, catalyst for preparing methyl acetate by carbonylation of dimethyl ether and method	20210223
CN-112898361-A	5-O-mycylamine glycosyl tylosin lactone derivative and preparation method and application thereof	20210201

PMID	Publication Date	Title	Journal
22229861	20120220	Metal site-mediated, thermally induced structural changes in Cr6+-silicalite-2 (MEL) molecular sieves	Inorganic chemistry
21995292	20111107	Synthesis, characterization, and spectroscopic characteristics of chromium(6+) and -(4+) silicalite-2 (ZSM-11) materials	Inorganic chemistry
21582128	20090204	2-Cyclo-hexyl-4-[(3,5-dimethyl-piperidin-1-yl)meth-yl]-5-methyl-phenol	Acta crystallographica. Section E, Structure reports online
18491285	20080601	Identification of the related substances of tilmicosin by liquid chromatography/ion trap mass spectrometry	Rapid communications in mass spectrometry : RCM
16674037	20060512	Combined experimental and computational study of the thermochemistry of methylpiperidines	The Journal of organic chemistry

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Related Functional Groups

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GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Warning

Complexity:	62.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	113.120449483
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	113.120449483
Rotatable Bond Count:	0
Topological Polar Surface Area:	12 Å²
Undefined Atom Stereocenter Count:	2
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5