Basic information
- CAS
43101-48-0- Standard SMILES
CCOC(=O)CC(N)C(=O)OCC- InChIKey
HMNXRLQSCJJMBT-UHFFFAOYSA-N- Molecular formula
- C8H15NO4
- Average molar mass
- 189.21 g/mol
- Monoisotopic mass
- 189.10010796
Names & identifiers
- Preferred name
- Aspartic acid, 1,4-diethyl ester
- IUPAC
- diethyl 2-aminobutanedioate
- English name
- diethyl DL-aspartate
- Molecular formula
- C8H15NO4
- Molecular weight
- 189.21
Names & synonyms
DTXSID70885886Aspartic acid, 1,4-diethyl esterRefChem:560216DTXCID20968916diethyl 2-aminobutanedioate43101-48-0Aspartic acid, diethyl esterAspartic acid, diethyl ester, hydrochlorideDiethyl 2-aminosuccinateDiethyl 1-amino-1,2-ethylenedicarboxylateSCHEMBL1172846ALBB-021341
Show more names
Einecs 256-095-6diethyl DL-aspartatediethyl (R,S)-aspartateDL-Aspartic acid diethyl(±)-Aspartic acid diethylAspartic Acid Diethyl Ester Hydrogen Chloride
MFCD00051355AKOS015997814CS-W001836HY-W001836PD196616
Database identifiers
- CAS
43101-48-0- PubChem CID
- 423728
- DTXSID
DTXSID70885886- EC Number
- 256-095-6
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 181
Experimental & physicochemical properties
CosmeticsAntistatic; Skin conditioning
Physicochemical properties
- Boiling point
- 259.5 · 259.5±25.0 °C(Predicted)
- Density
- 1.102 · 1.102±0.06 g/cm3(Predicted)
- solubility
- Ethanol, Water
- pka
- 6.19 · 6.19±0.33(Predicted)
- form
- Solid
- color
- White
- Cosmetics Ingredients Functions
- SKIN CONDITIONINGANTISTATIC
- EPA Substance Registry System
- Aspartic acid, diethyl ester (43101-48-0)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
Use ClassificationCosmetics -> Antistatic; Skin conditioning
General Manufacturing InformationAspartic acid, 1,4-diethyl ester: INACTIVE
Applications
UsesAspartic Acid Diethyl Ester is an intermediate in the synthesis of Aspartic Acid (A788955) related compounds.
Suppliers6 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
3 records
Compound notes
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