CAS 35794-11-7|piperidine, 3,5-dimethyl-|3,5-Dimethylpiperidine|3,5-dimethylpiperidine|3,5-Lupetidine|3,5-二甲基哌啶|3,5-二甲基哌啶（顺反异构体混合物）|3,5-二甲基哌啶,顺式+反式|3,5-Dimethylpiperidin...

Molecular Formula

C₇H₁₅N

Molecular Mass

113.2007

Exact Mass

113.12044949

InChI

InChI=1S/C7H15N/c1-6-3-7(2)5-8-4-6/h6-8H,3-5H2,1-2H3

InChIKey

IDWRJRPUIXRFRX-UHFFFAOYSA-N

Canonic Smiles

CC1CNCC(C1)C

Isomeric Smiles

N1CC(CC(C1)C)C

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-1.8490533

LogD (pH = 7.4)

-1.5496185

Log P

1.3874333

Molar Refractivity

35.7786

Polarizability

14.445701

Polar Surface Area

12.03

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

118259

IUPAC Traditional name

piperidine, 3,5-dimethyl-

Synonyms

3,5-Dimethylpiperidine3,5-Lupetidine3,5-二甲基哌啶3,5-二甲基哌啶（顺反异构体混合物）3,5-二甲基哌啶,顺式+反式3,5-Dimethylpiperidine, cis + trans3,5-Dimethylpiperidine, mixture of cis and trans3,5-Dimethylpiperidine, cis + trans

IUPAC name

3,5-dimethylpiperidine

PubChem SID

CAS Number

MDL Number

Beilstein Number

Storage Warning

Irritant/Flammable

European Hazard Symbols

Irritant (Xi)

UN Number

1993

UN1993

Personal Protective Equipment

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Hazard Class

Packing Group

III

Risk Statements

10-36/37/38

GHS Pictograms

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Acute toxicity (oral, dermal, inhalation), category 4

Skin irritation, category 2

Eye irritation, category 2

Skin sensitisation, category 1

Specific Target Organ Toxicity – Single exposure, category 3

GHS Signal Word

Warning

RID/ADR

UN 1993 3/PG 3

German water hazard class

Safety Statements

16-26-36/37/39

26-37

GHS Precautionary statements

P261-P305+P351+P338

P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A

MSDS Link

Download link

GHS Hazard statements

H226-H315-H319-H335

TSCA Listed

是

Physical Property

Product Information

Purity

≥96%

97%

98%

Empirical Formula (Hill Notation)

C7H15N

No Data Available

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Sigma Aldrich

186104

Packaging
25 g in glass bottle
Application
Reactant for synthesis of: Substituted bisphenol A derivatives as β-amyloid peptide aggregation inhibitors1 MMP-13 selective isonipecotamide α-sulfone hydroxamates2 Gem-diamines for active organocatalysts for biodiesel production3 Benzimidazole inhibitors of the antigen receptor-mediated NF-κB4 Reactant for Mannich reactions to form Ru(II) complexes5

No Data Available

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