CAS 3238-60-6|2-propylpiperidine|2-n-Propylpiperidine|2-propylpiperidine|2-Propylpiperidine|(±)-Coniine

Molecular Formula

C₈H₁₇N

Molecular Mass

127.22728

Exact Mass

127.13609955

InChI

InChI=1S/C8H17N/c1-2-5-8-6-3-4-7-9-8/h8-9H,2-7H2,1H3

InChIKey

NDNUANOUGZGEPO-UHFFFAOYSA-N

Canonic Smiles

CCCC1CCCCN1

Isomeric Smiles

N1C(CCCC1)CCC

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-1.1946206

LogD (pH = 7.4)

-0.8684037

Log P

2.0411537

Molar Refractivity

40.3792

Polarizability

16.292534

Polar Surface Area

12.03

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

9985

IUPAC Traditional name

2-propylpiperidine

IUPAC name

2-propylpiperidine

Synonyms

2-n-Propylpiperidine2-Propylpiperidine(±)-Coniine

PubChem SID

MDL Number

CAS Number

MSDS Link

TSCA Listed

false

Storage Warning

IRRITANT, TOXIC

GHS Precautionary statements

P261-P280-P301+P310-P311

Risk Statements

23/24/25-40

Safety Statements

22-36/37/39-45

RID/ADR

UN 2810 6.1/PG 2

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), categories 1,2,3

Respiratory sensitization, category 1

Germ cell mutagenicity, categories 1A,1B,2

Carcinogenicity, categories 1A,1B,2

Reproductive toxicity, categories 1A,1B,2

Specific Target Organ Toxicity – Single exposure, categories 1,2

Specific Target Organ Toxicity – Repeated exposure, categories 1,2

Aspiration Hazard, category 1

Storage Temperature

2-8°C

European Hazard Symbols

Toxic (T)

Hazard Class

6.1

GHS Signal Word

Danger

Personal Protective Equipment

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

GHS Hazard statements

H226-H301-H311-H331-H351

Packing Group

UN Number

2810

German water hazard class

Product Information

Purity

97%

≥98%

Empirical Formula (Hill Notation)

C8H17N

Physical Property

Apperance

, clear colorless to yellow-green liquid

Flash Point

48 °C

118.4 °F

Density

0.85 g/mL at 25 °C(lit.)

No Data Available

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No Data Available

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Sigma Aldrich

C9392

Other Notes
Toxic principle of poison hemlock (racemic modification).

No Data Available

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Academic Data

PubChem

9985

IUPAC Traditional name

2-propylpiperidine

IUPAC name

2-propylpiperidine

Synonyms

2-n-Propylpiperidine2-Propylpiperidine(±)-Coniine

PubChem SID

MDL Number

CAS Number

C9392

Other Notes
Toxic principle of poison hemlock (racemic modification).

No Data Available

Click here to submit data

Safety Information

Product Information

Purity

97%

≥98%

Empirical Formula (Hill Notation)

C8H17N

Physical Property

Apperance

, clear colorless to yellow-green liquid

Flash Point

48 °C

118.4 °F

Density

0.85 g/mL at 25 °C(lit.)

Molecule

ID:38367