Basic information
- Standard SMILES
CCNC1CCCCC1- InChIKey
AGVKXDPPPSLISR-UHFFFAOYSA-N- Molecular formula
- C8H17N
- Average molar mass
- 127.23 g/mol
- Monoisotopic mass
- 127.13609954
Overview
Ethyl-n-cyclohexylamine appears as a clear colorless liquid with an ammonia-like odor. Floats on water and slightly soluble in water. Vapors heavier than air. Produces toxic oxides of nitrogen during combustion.
Names & identifiers
- Preferred name
- N-Ethyl cyclohexylamine
- IUPAC
- N-ethylcyclohexanamine
- English name
- N-Ethylcyclohexylamine
- Molecular formula
- C8H17N
- Molecular weight
- 127.23
Names & synonyms
N-Ethylcyclohexylamine5459-93-8N-EthylcyclohexanamineCyclohexanamine, N-ethyl-N-CyclohexylethylamineVulkacit HXAccelerator HXCyclohexylamine, N-ethyl-(Ethylamino)cyclohexaneN-ETHYL CYCLOHEXYLAMINECyclohexane, (ethylamino)-YJK13P0H3E
Show more names
NECHANsc6272vulkacithxWln: L6tj am2acceleratorhx
NSC-6272DTXSID8063913RefChem:1091728DTXCID7041754226-733-8Cyclohexyl(ethyl)amineN-Ethyl(cyclohexyl)amineEthylcyclohexylamine
Database identifiers
- CAS
5459-93-8- PubChem CID
- 21609
- DTXSID
DTXSID8063913- UNII
- YJK13P0H3E
- EC Number
- 226-733-8
- Nikkaji
- J23.471K
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 65
Experimental & physicochemical properties
Chemical Classes
Nitrogen Compounds -> Amines, Aliphatic
Corrosives
Density
0.8527 at 77 °F (USCG, 1999) - Less dense than water; will float
0.868 @ 0 °C/0 °C
SolubilitySLIGHTLY SOL IN WATER; SOL IN ALL PROP IN ALCOHOL, ETHER
Flash Point
85 °F ; 115 °F (cc) (USCG, 1999)
86 °F OC
Boiling Point
329 °F at 760 mmHg (USCG, 1999)
164 °C @ 760 MM HG
Melting Point-49 °F (USCG, 1999)
Vapor Density4.4 (AIR= 1)
Physical Description
Ethyl-n-cyclohexylamine appears as a clear colorless liquid with an ammonia-like odor. Floats on water and slightly soluble in water. Vapors heavier than air. Produces toxic oxides of nitrogen during combustion.
Colorless clear liquid with an ammoniacal odor; [CAMEO]
Autoignition Temperature545 °F (USCG, 1999)
Physicochemical properties
- Melting point
- -15 °C · -15°C (estimate)
- Boiling point
- 165 °C · 165 °C (lit.)
- Density
- 0.844 g/mL · 0.844 g/mL at 25 °C (lit.)
- vapor density
- 4.4 · 4.4 (vs air)
- vapor pressure
- 2 mm · 2 mm Hg ( 20 °C)
- refractive index
- 20 · n20/D 1.452(lit.)
- Flash point
- 111 °F · 111 °F
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- Liquid
- pka
- 11.16 · 11.16±0.20(Predicted)
- color
- Clear colorless to light yellow
- explosive limit
- 7.6 % · 7.6%
- BRN
- 2070280 · 2070280
- InChI
- 1S/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H3
- InChIKey
- AGVKXDPPPSLISR-UHFFFAOYSA-N
- SMILES
- CCNC1CCCCC1
- LogP
- 1.027 at · 1.027 at 25℃ and pH7.75
- CAS DataBase Reference
- 5459 · 5459-93-8(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 13 P0H3E · YJK13P0H3E
- NIST Chemistry Reference
- Cyclohexanamine, N-ethyl-(5459-93-8)
- EPA Substance Registry System
- N-Ethylcyclohexylamine (5459-93-8)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 226 · H226-H302+H332-H311-H314
- Precautionary statements
- 210 · P210-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- C
- Risk Statements
- 10 · 10-20/21/22-35
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 2734 · UN 2734 8/PG 2
- WGK Germany
- 3 · 3
- RTECS
- 1225000 · GX1225000
- Autoignition Temperature
- 473 °F · 473 °F
- TSCA
- TSCA listed
- HazardClass
- 8 · 8
- PackingGroup
- II
- HS Code
- 29213000 · 29213000
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 3 DermalAcute · Acute Tox. 3 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralFlam. Liq. 3Skin Corr. 1A
- Hazardous Substances Data
- 5459 · 5459-93-8(Hazardous Substances Data)
- REACH Registrations
- Active
- Limited Quantities
- 1 L · 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 212 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Cyclohexanamine, N-ethyl-
Status: Active Update: 20-05-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/11208
Cyclohexanamine, N-ethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
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.)
DOT LabelFlammable Liquid
Fire HazardsBehavior in Fire: Dangerous when exposed to heat or flame. Can react vigorously with oxidizing materials. (USCG, 1999)
Fire PotentialDANGEROUS, WHEN EXPOSED TO HEAT, FLAME, OR OXIDIZERS
Health HazardsInhalation of high concentration of vapor will produce irritation of the respiratory tract and lungs. Inhalation of large quantities of vapor may be fatal. (USCG, 1999)
Hazards Summary
Corrosive and toxic; [Hawley] External application to rabbit eyes scored 9 on a scale of 1-10 (10 being most severe) for degree of injury after 24 hours; Emergency treatment: Irritants; [HSDB] Lung and respiratory tract irritant; [CAMEO] Vapor is irritating to eyes, nose, and throat; Liquid can burn skin and eyes; [CHRIS] A severe skin and eye irritant; [RTECS] A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may result in chemical pneumonitis; [Alfa Aesar MSDS]
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity AlertsHighly Flammable
Reactivity Profile
ETHYL-N-CYCLOHEXYLAMINE 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.
Air and Water ReactionsHighly flammable. Slightly soluble in water.
NFPA Hazard Classification
3 - Materials that, under emergency conditions, can cause serious or permanent injury.
3 - Liquids and solids that can be ignited under almost all ambient temperature conditions. Materials produce hazardous atmospheres with air under almost all ambient temperatures or, though unaffected by ambient temperatures, are readily ignited under almost all conditions.
0 - Materials that in themselves are normally stable, even under fire conditions.
Hazard Classes and Categories
Flam. Liq. 3 (100%)
Corrosives, Flammable agents - 3rd degree
Safety & protection
Fire FightingExcerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
First AidINHALATION: Remove from exposure area. Prompt medical attention required.
Fire Fighting ProceduresALCOHOL FOAM, MIST, SPRAY, DRY CHEMICAL
Nonfire Spill ResponseExcerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
Isolation and EvacuationExcerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:
Personal Protective Equipment (PPE)Gas mask suitable for ammonia; face shield or splash proof goggles; rubber gloves. If entering spill area, wear self-contained breathing apparatus and full protective clothing, including boots. (USCG, 1999)
Toxicology
Adverse EffectsDermatotoxin - Skin burns.
Non-Human Toxicity Excerpts...RATED 9 ON RABBIT EYES. /SUBSTANCE HAS BEEN TESTED EXTERNALLY & RATED ON A SCALE OF 1-10 ACCORDING TO DEG OF INJURY OBSERVED AFTER 24 HR. MOST SEVERE INJURIES HAVE BEEN RATED 10./
Toxicity DataLCLo (rat) = 500 ppm/4h
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- GX1225000
- ridadr
- UN 2734 8/PG 2
- hs_code
- 29213000
- risk_code
- 10-20/21/22-35
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS06
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H226-H302+H332-H311-H314
- Limited Quantities
- 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralFlam. Liq. 3Skin Corr. 1A
- Autoignition Temperature
- 473 °F
- Precautionary statements
- P210-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
- Hazardous Substances Data
- 5459-93-8(Hazardous Substances Data)
Chemistry & industry
Uses & manufacturing
UsesUsed as intermediate in the production of herbicides and pharmaceuticals; [Hawley]
General Manufacturing InformationCyclohexanamine, N-ethyl-: ACTIVE
Applications
UsesIntermediate in production of herbicides and pharmaceuticals.
UsesN-Ethylcyclohexylamine can be used in the synthesis of a series of isatin-N-Mannich bases.
General DescriptionA clear colorless liquid with an ammonia-like odor. Floats on water and slightly soluble in water. Vapors heavier than air. Produces toxic oxides of nitrogen during combustion.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海沛灵生物科技有限公司13127581762 13127581762 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
衢州明锋化工有限公司0570-3062502 13819002126;13819008176 · [email protected]
Syntechem Co.,Ltd[email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
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玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
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上海将来实业股份有限公司021-61552785 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
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Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
成都瑞欧克科技有限公司028-64353063 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
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成都润泽本土化工有限公司028-88469284 18000562381 · [email protected]
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Related reactions
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