N,N-Diethyl-2-hydroxyacetamide
Basic information
- CAS
39096-01-0- Standard SMILES
CCN(CC)C(=O)CO- InChIKey
RZCCQWOCSZOHMQ-UHFFFAOYSA-N- Molecular formula
- C6H13NO2
- Average molar mass
- 131.17 g/mol
- Monoisotopic mass
- 131.09462866
Names & identifiers
- Preferred name
- N,N-Diethyl-2-hydroxyacetamide
- IUPAC
- N,N-diethyl-2-hydroxyacetamide
- English name
- 2-Hydroxy-N,N-diethylacetamide
- Molecular formula
- C6H13NO2
- Molecular weight
- 131.17
Names & synonyms
N,N-Diethyl-2-hydroxyacetamide39096-01-0DTXSID80399767RefChem:358980DTXCID10350624626-027-3MFCD018637012-HYDROXY-N,N-DIETHYLACETAMIDEn,n-diethyl-2-hydroxy-acetamideAcetamide, N,N-diethyl-2-hydroxy-hydroxyacetic acid diethylamide2-Hydroxy-N,N-diethylacetamide; N,N-Diethylglycolamide; N,N-diethylglycolamide;
Show more names
N,N-DIETHYLGLYCOLAMIDEN,N-Diethyl-2-hydroxyacetamide 96%
glycolic acid diethylamideSCHEMBL408418SCHEMBL1555178RZCCQWOCSZOHMQ-UHFFFAOYSA-NAKOS001288283N,N-Diethyl-2-hydroxyacetamide, 96%AS-60256SY113904
Database identifiers
- CAS
39096-01-0- PubChem CID
- 4137580
- DTXSID
DTXSID80399767- EC Number
- 626-027-3
- Nikkaji
- J2.493.438A
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 89.1
Physicochemical properties
- Boiling point
- 238 °C · 238 °C (lit.)
- Density
- 1.009 g/mL · 1.009 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.457(lit.)
- Flash point
- 220 °F · 220 °F
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Sparingly), Methanol (Slightly)
- form
- Oil
- color
- Colourless
- InChI
- 1S/C6H13NO2/c1-3-7(4-2)6(9)5-8/h8H,3-5H2,1-2H3
- InChIKey
- RZCCQWOCSZOHMQ-UHFFFAOYSA-N
- SMILES
- CCN(CC)C(=O)CO
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/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 39 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 10 - Combustible liquids
- 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
Applications
UsesN,N-Diethyl-2-hydroxyacetamide is a reactant used in the synthesis of phosphonate prodrugs to increase the oral bioavailability of an antiviral agent 9-[2-(Phosphonomethoxy)ethyl]adenine (PMEA).
Suppliers
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Related reactions
9 records
Compound notes
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