Basic information
- CAS
6290-05-7- Standard SMILES
CCOC(=O)CNCC(=O)OCC- InChIKey
LJDNMOCAQVXVKY-UHFFFAOYSA-N- Molecular formula
- C8H15NO4
- Average molar mass
- 189.21 g/mol
- Monoisotopic mass
- 189.10010796
Names & identifiers
- Preferred name
- Diethyl iminodiacetate
- IUPAC
- ethyl 2-[(2-ethoxy-2-oxoethyl)amino]acetate
- English name
- Diethyl iminodiacetate
- Molecular formula
- C8H15NO4
- Molecular weight
- 189.21
Names & synonyms
Diethyl iminodiacetate6290-05-7Glycine, N-(2-ethoxy-2-oxoethyl)-, ethyl esterNSC 6950EINECS 228-533-6DTXSID0064200RefChem:133419DTXCID2043585N,NBis(ethoxycarbonylmethyl)amineEthyl N(2ethoxy2oxoethyl)glycinateAcetic acid, iminodi, diethyl esterGlycine, N(2ethoxy2oxoethyl), ethyl ester
Show more names
N1-((ethylimino)methylene)-N3,N3-dimethylpropane-1,3-diamine hydrochloride)-, ethyLDiethylIminodiacetate>Diethyl iminodiacetate 98%Diethyl iminodiacetate,99%Diethyl iminodiacetic acidycine, N-(2-ethoxy-2-oxoethyLDiethyl iMinodiacetate, 99% 5GR
LJDNMOCAQVXVKY-UHFFFAOYSA-NDiethyl 2,2'-azanediyldiacetateIminodiacetic acid diethyl esterDIETHYLIMINODIACETATEethyl 2-[(2-ethoxy-2-oxoethyl)amino]acetateN,N-Bis(ethoxycarbonylmethyl)amineMFCD00041925Acetic acid, iminodi-, diethyl ester
Database identifiers
- CAS
6290-05-7- PubChem CID
- 80502
- DTXSID
DTXSID0064200- UNII
- FQH4U4VY8P
- EC Number
- 228-533-6
- Nikkaji
- J35.497J
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 152
Experimental & physicochemical properties
Physical DescriptionLiquid; [Alfa Aesar MSDS]
Physicochemical properties
- Boiling point
- 208 °C · 208 °C (lit.)
- Density
- 1.056 g/mL · 1.056 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.435(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- pka
- 4.92 · 4.92±0.20(Predicted)
- form
- Viscous Liquid
- color
- Clear light yellow to yellow
- Water Solubility
- Moderately soluble in water.
- InChI
- InChI=1S/C8H15NO4/c1-3-12-7(10)5-9-6-8(11)13-4-2/h9H,3-6H2,1-2H3
- InChIKey
- LJDNMOCAQVXVKY-UHFFFAOYSA-N
- SMILES
- C(OCC)(=O)CNCC(OCC)=O
- CAS DataBase Reference
- 6290 · 6290-05-7(CAS DataBase Reference)
- EPA Substance Registry System
- Glycine, N-(2-ethoxy-2-oxoethyl)-, ethyl ester (6290-05-7)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36-37/39
- RIDADR
- 1993 · 1993
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HazardClass
- 3.2 · 3.2
- PackingGroup
- III
- HS Code
- 29252900 · 29252900
- Storage Class
- 10 · 10 - Combustible liquids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazards SummaryA skin and strong eye irritant; [Alfa Aesar MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (97.7%)；STOT SE 3 (97.7%)
Safety data
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- 1993
- hs_code
- 29252900
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-37/39
- hazard_class
- 3.2
- Storage Class
- 10 - Combustible liquids
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationGlycine, N-(2-ethoxy-2-oxoethyl)-, ethyl ester: ACTIVE
Applications
UsesIt is mainly used for the manufacture of N-(Phosphonomethyl) iminodiacetic acid and glyphosate. Used as raw material for ion exchange resin; for rubbers, electroplating and food additives.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]
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四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
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TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
Shanghai Witofly Chemical Co.,Ltd[email protected]
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Related reactions
55 records
Compound notes
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