Basic information
- CAS
766-09-6- Standard SMILES
CCN1CCCCC1- InChIKey
HTLZVHNRZJPSMI-UHFFFAOYSA-N- Molecular formula
- C7H15N
- Average molar mass
- 113.2 g/mol
- Monoisotopic mass
- 113.12044948
Overview
1-ethylpiperidine appears as a colorless liquid with the odor of pepper. Less dense than water. May irritate skin and eyes. Vapors heavier than air. Used as a solvent and to make other chemicals.
Names & identifiers
- Preferred name
- N-Ethylpiperidine
- IUPAC
- 1-ethylpiperidine
- English name
- 1-Ethylpiperidine
- Molecular formula
- C7H15N
- Molecular weight
- 113.2
Names & synonyms
Show more names
Database identifiers
- CAS
766-09-6- PubChem CID
- 13007
- DTXSID
DTXSID1061102- ChEMBL
CHEMBL25053- ChEBI
CHEBI:39017- UNII
- 7IE43L0926
- EC Number
- 212-161-6
- Nikkaji
- J35.452J
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 55.4
Experimental & physicochemical properties
Physical Description
1-ethylpiperidine appears as a colorless liquid with the odor of pepper. Less dense than water. May irritate skin and eyes. Vapors heavier than air. Used as a solvent and to make other chemicals.
Liquid
Physicochemical properties
- Melting point
- -20 °C · -20 °C
- Boiling point
- 131 °C · 131 °C(lit.)
- Density
- 0.824 g/mL · 0.824 g/mL at 25 °C(lit.)
- vapor pressure
- 12.76 hPa · 12.76hPa at 20℃
- refractive index
- 20 · n20/D 1.444(lit.)
- Flash point
- 66 °F · 66 °F
- storage temp.
- Flammables area
- solubility
- 1 · 1-ethylpiperidine salt of benzylpenicillin is considerably less soluble in amyl acetate and acetone.
- pka
- 10.45 · 10.45(at 23℃)
- form
- Liquid
- color
- Clear colorless to slightly yellow
- PH
- 12.2 · 12.2 (50g/l, H2O, 20℃)
- explosive limit
- 1.9 · 1.9-12.1%(V)
- Water Solubility
- 50 G/L · 50 G/L
- BRN
- 102643 · 102643
- Henry's Law Constant
- 3.9 · 3.9×10-1 mol/(m3Pa) at 25℃, Hilal et al. (2008)
- InChI
- 1S/C7H15N/c1-2-8-6-4-3-5-7-8/h2-7H2,1H3
- InChIKey
- HTLZVHNRZJPSMI-UHFFFAOYSA-N
- SMILES
- CCN1CCCCC1
- LogP
- 1.89 at · 1.89 at 25℃
- CAS DataBase Reference
- 766 · 766-09-6(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 7 IE43L0926 · 7IE43L0926
- NIST Chemistry Reference
- 1 · Piperidine, 1-ethyl-(766-09-6)
- EPA Substance Registry System
- 1 · Piperidine, 1-ethyl- (766-09-6)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302+H312+H332-H314-H225
- Precautionary statements
- 501 · P501-P261-P270-P240-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P362+P364-P303+P361+P353-P301+P330+P331-P301+P312+P330-P304+P340+P310-P305+P351+P338+P310-P403+P235-P405
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- F,Xn
- Risk Statements
- 11 · 11-20/22-36/37/38
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 2386 · UN 2386
- WGK Germany
- 1 · 1
- RTECS
- 250000 · TN0250000
- F
- 10 · 10-23
- TSCA
- TSCA listed
- HazardClass
- 3 · 3
- PackingGroup
- II
- HS Code
- 29333990 · 29333990
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 3 InhalationAcute · Acute Tox. 3 InhalationAcute Tox. 3 OralAcute Tox. 4 DermalEye Dam. 1Flam. Liq. 2Skin Corr. 1B
- REACH Registrations
- Active
- Limited Quantities
- 1 L · 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 213 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Piperidine, 1-ethyl-
Piperidine, 1-ethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Piperidine, 1-ethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 16-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/11076
Piperidine, 1-ethyl-: HSNO Approval: HSR001045 Approved with controls
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
Fire Hazards
Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:
· Flammable/combustible material.
Health Hazards
Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:
· May cause toxic effects if inhaled or ingested.
Reactivity Profile
1-ETHYLPIPERIDINE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.
DOT Hazard Classification
1-Ethylpiperidine
UN2386
Class 3 Flammable and combustible liquid (49 eCFR § 173.120)
Class 3 Flammable and combustible liquid (49 eCFR § 173.120)
PG II: the degree of danger presented by the material is medium
Hazard Classes and Categories
Flam. Liq. 2 (100%)
Flammable agents - 3rd degree
Safety & protection
Accidental Release Measures
· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.
· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.
First Aid
Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:
General First Aid:
Isolation and Evacuation
Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:
Immediate precautionary measure
Safety data
- F
- 10-23
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- TN0250000
- ridadr
- UN 2386
- hs_code
- 29333990
- risk_code
- 11-20/22-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS07
- hazard_code
- F,Xn
- safety_code
- 26-36/37/39
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H302+H312+H332-H314-H225
- Limited Quantities
- 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 3 InhalationAcute Tox. 3 OralAcute Tox. 4 DermalEye Dam. 1Flam. Liq. 2Skin Corr. 1B
- Precautionary statements
- P501-P261-P270-P240-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P362+P364-P303+P361+P353-P301+P330+P331-P301+P312+P330-P304+P340+P310-P305+P351+P338+P310-P403+P235-P405
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Piperidine, 1-ethyl-: ACTIVE
Applications
UsesReactant for: Synthesis of multiprotected kanosamine1 Selective acylation in peptide synthesis2Reagent for: Stereoselective aldol condensation reactions for synthesis of β-lactam antibiotics3 Diastereoselective synthesis of aldols4 Crossed Claisen ester condensation5
UsesIn Room temperature phosphorescence of α-bromonaphthalene induced by cyclodextrin in the presence of hexahydropyridine or 1-ethylpiperidine and its application is described. The highest yields of 5-Bromopyrimidine (37%) were obtained by using 1-ethylpiperidine or triethylamine as condensing agent. Tributyltin hydride and 1-ethylpiperidine hypophosphite were mediated intermolecular radical additions to 2, 4, 6-trichlorophenyl vinyl sulfonate.
General DescriptionA colorless liquid with the odor of pepper. Less dense than water. Flash point 66°F. May irritate skin and eyes. Vapors heavier than air. Used as a solvent and to make other chemicals.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers69 total
Additional notes
DefinitionChEBI: N-ethylpiperidine is a member of piperidines.
Related reactions
Compound notes
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