1,2-Ethanediamine, N1,N1-diethyl-N2-methyl-
Basic information
- CAS
104-79-0- Standard SMILES
CCN(CC)CCNC- InChIKey
MKDYQLJYEBWUIG-UHFFFAOYSA-N- Molecular formula
- C7H18N2
- Average molar mass
- 130.23 g/mol
- Monoisotopic mass
- 130.14699858
Names & identifiers
- Preferred name
- 1,2-Ethanediamine, N1,N1-diethyl-N2-methyl-
- IUPAC
- N',N'-diethyl-N-methylethane-1,2-diamine
- English name
- N,N-Diethyl-N'-methylethylenediamine
- Molecular formula
- C7H18N2
- Molecular weight
- 130.23
Names & synonyms
104-79-0N,N-Diethyl-N'-methylethylenediamine2-(Diethylamino)-N-methylethylamineDiethyl(2-methylaminoethyl)amineEthylenediamine, N,N-diethyl-N'-methyl-(2-(Diethylamino)ethyl)methylamine[2-(Diethylamino)ethyl]methylamineEINECS 203-238-51,2-Ethanediamine, N1,N1-diethyl-N2-methyl-NSC 27480RefChem:411915Ethylenediamine, N,N-diethyl-N'-methyl-(8CI)
Show more names
N,N-Diethyl-N'-methylenediamineN, N-Diethyl-N-methylethylendiaminen,n-diethyl-n’-methyl-2-ethanediamineN,N-Diethyl-N'-methylethane-1,2-diamine
203-238-5N1,N1-Diethyl-N2-methylethane-1,2-diamine1,2-Ethanediamine, N,N-diethyl-N'-methyl-diethyl[2-(methylamino)ethyl]amineN',N'-diethyl-N-methylethane-1,2-diamineMFCD00009053E57SYE7WSPN,N-Diethyl-N/'-methylethylenediamine
Database identifiers
- CAS
104-79-0- PubChem CID
- 66034
- DTXSID
DTXSID2059304- UNII
- E57SYE7WSP
- EC Number
- 203-238-5
- Nikkaji
- J25.730C
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 50.9
Physicochemical properties
- Melting point
- 28.9 °C · 28.9°C (estimate)
- Boiling point
- 157 · 157-160 °C(lit.)
- Density
- 0.805 g/mL · 0.805 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.4296(lit.)
- Flash point
- 106 °F · 106 °F
- storage temp.
- Flammables area
- solubility
- Chloroform (Soluble), Methanol (Soluble)
- pka
- 10.49 · 10.49±0.10(Predicted)
- form
- clear liquid
- color
- Colorless to Almost colorless
- InChI
- 1S/C7H18N2/c1-4-9(5-2)7-6-8-3/h8H,4-7H2,1-3H3
- InChIKey
- MKDYQLJYEBWUIG-UHFFFAOYSA-N
- SMILES
- CCN(CC)CCNC
- CAS DataBase Reference
- 104 · 104-79-0(CAS DataBase Reference)
- FDA UNII
- 57 SYE7WSP · E57SYE7WSP
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- 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
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05
- hazard_code
- C
- safety_code
- 16-26-27-36/37/39-45
- hazard_class
- 8
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H226-H314
- Hazard Classifications
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2-Ethanediamine, N1,N1-diethyl-N2-methyl-: INACTIVE
Applications
UsesN,N-Diethyl-N′-methylethylenediamine was used as a derivatization agent in the quantitative determination of isocyanates by capillary electrophoresis with tris(2,2′-bipyridyl)ruthenium(II) electrochemiluminescence (ECL).
General DescriptionThe Michael addition of N,N-Diethyl-N′-methylethylenediamine to nocathiacin was studied.
Related reactions
219 records
Compound notes
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