Basic information
- Standard SMILES
CCNCCN- InChIKey
SCZVXVGZMZRGRU-UHFFFAOYSA-N- Molecular formula
- C4H12N2
- Average molar mass
- 88.15 g/mol
- Monoisotopic mass
- 88.10004838
Names & identifiers
- Preferred name
- N-Ethylethylenediamine
- IUPAC
- N'-ethylethane-1,2-diamine
- English name
- 2-Aminoethyl(ethyl)amine
- Molecular formula
- C4H12N2
- Molecular weight
- 88.15
Names & synonyms
N-Ethylethylenediamine2-Aminoethyl(ethyl)amine1,2-Ethanediamine, N-ethyl-2-EthylaminoethylamineN-Ethyl ethylenediamine1,2-Ethanediamine, N1-ethyl-2-(ethylamino)ethylamineN-EthylenediamineN-(2-aminoethyl)ethylamineEINECS 203-795-4UNII-941MVD708NCCRIS 8925
Show more names
N1-ethylethane-1,2-diaMineEAEAEthylethylenediamineN,N-Dimethyl-N’ETHYLAMINO ETHYLAMINEN-ETHYLETHYLENDIAMINEN-EthylethylnediaMine
1-ethylethylenediamineAI3-26672941MVD708Nn-ethyl-1,2-diaminoethaneETHYLETHYLENEDIAMINE, N-DTXSID8059390RefChem:163347DTXCID1033165
Database identifiers
- CAS
110-72-5- PubChem CID
- 66071
- DTXSID
DTXSID8059390- ChEMBL
CHEMBL70445- UNII
- 941MVD708N
- EC Number
- 203-795-4
- Nikkaji
- J25.749D
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 21.5
Physicochemical properties
- Melting point
- 1.63 °C · 1.63°C (estimate)
- Boiling point
- 128 · 128-130 °C (lit.)
- Density
- 0.837 g/mL · 0.837 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.439(lit.)
- Flash point
- 50 °F · 50 °F
- storage temp.
- Flammables area
- Water Solubility
- Completely soluble in water
- pka
- 1 · pK1:7.63(+2);pK2:10.56(+1) (25°C)
- form
- Liquid
- color
- Clear colorless to slightly brown
- Sensitive
- Air Sensitive
- BRN
- 1098272 · 1098272
- InChI
- 1S/C4H12N2/c1-2-6-4-3-5/h6H,2-5H2,1H3
- InChIKey
- SCZVXVGZMZRGRU-UHFFFAOYSA-N
- SMILES
- CCNCCN
- CAS DataBase Reference
- 110 · 110-72-5(CAS DataBase Reference)
- FDA UNII
- 941 MVD708N · 941MVD708N
- NIST Chemistry Reference
- 1 · 1,2-Ethanediamine, N-ethyl-(110-72-5)
- EPA Substance Registry System
- 1 · 1,2-Ethanediamine, N-ethyl- (110-72-5)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS08
- Signal word
- Danger
- Hazard statements
- 225 · H225-H314-H334
- Precautionary statements
- 210 · P210-P233-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- C,F
- Risk Statements
- 10 · 10-34-43-11
- Safety Statements
- 26 · 26-36/37/39-45-25-16
- RIDADR
- 2734 · UN 2734 8/PG 2
- WGK Germany
- 3 · 3
- F
- 10 · 10-23
- Hazard Note
- Flammable/Corrosive
- TSCA
- TSCA listed
- HazardClass
- 3 · 3
- PackingGroup
- III
- HS Code
- 29212900 · 29212900
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 2 Resp · Flam. Liq. 2Resp. Sens. 1Skin Corr. 1B
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 45.1% (37 of 82) of reports.
Danger
H225 (48.8%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P271, P280, P284, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P342+P316, P363, P370+P378, P403, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 82 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 2 (48.8%)
Safety data
- F
- 10-23
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2734 8/PG 2
- hs_code
- 29212900
- risk_code
- 10-34-43-11
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS08
- hazard_code
- C,F
- hazard_note
- Flammable/Corrosive
- safety_code
- 26-36/37/39-45-25-16
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- III
- Hazard statements
- H225-H314-H334
- Hazard Classifications
- Flam. Liq. 2Resp. Sens. 1Skin Corr. 1B
- Precautionary statements
- P210-P233-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2-Ethanediamine, N1-ethyl-: ACTIVE
Applications
UsesN-Ethylethylenediamine is a chelating agent used in mutagenesis research studies. It undergoes condensation with 2-hydroxy-3-methoxybenzaldehyde. It also forms organometallic ruthenium(II) complexes that inhibit the growth in human ovarian cancer cell lines.
General DescriptionN-Ethylethylenediamine undergoes condensation with 2-hydroxy-3-methoxybenzaldehyde. It also forms organometallic ruthenium(II) complexes that inhibit the growth in human ovarian cancer cell lines.
Upstream & downstream products
Upstream raw materials
Downstream products
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Related reactions
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