Basic information
- CAS
39994-70-2- Standard SMILES
CCOC(=O)[C@@H](N)[C@@H](C)O.Cl- InChIKey
WHKKNTASOQMDMH-JBUOLDKXSA-N- Molecular formula
- C6H14ClNO3
- Average molar mass
- 183.63 g/mol
- Monoisotopic mass
- 183.06622099
Names & identifiers
- Preferred name
- Ethyl L-threoninate hydrochloride
- IUPAC
- ethyl (2S,3R)-2-amino-3-hydroxybutanoate;hydrochloride
- English name
- L-Threonine ethyl ester hydrochloride
- Molecular formula
- C6H14ClNO3
- Molecular weight
- 183.63
Names & synonyms
39994-70-2Ethyl L-threoninate hydrochlorideEthyl L-threoninate HClEINECS 254-736-4DTXSID60193048RefChem:138975DTXCID70115539254-736-4(2S,3R)-Ethyl 2-amino-3-hydroxybutanoate hydrochlorideL-THREONINE ETHYL ESTER HYDROCHLORIDEMFCD07437964L-Threonine, ethyl ester, hydrochloride
Show more names
THR-OET.HCLL-Thr-OEtHClH-Thr-OEt.HClL-Threonine ethyl esL-THREONINEETHYLESTERHYDROCHLThreonine ethyl·hydrochlorideEthyl L-threoninate hydrochloride (1:1)L-Threonine ethyl ester hydrochloride, 98%
ethyl (2S,3R)-2-amino-3-hydroxybutanoate;hydrochloride(2S,3R)-ETHYL 2-AMINO-3-HYDROXYBUTANOATE HCLEthyl L-threoninate--hydrogen chloride (1/1)SCHEMBL2407086threonine ethyl ester hydrochlorideAKOS015932672AKOS016004465CS-W021073
Database identifiers
- CAS
39994-70-2- PubChem CID
- 2763096
Properties
Computed structural properties
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 116
Physicochemical properties
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- form
- Viscous Liquid
- color
- Colorless to light yellow
- optical activity
- -9.5 ° · -9.5°(C=0.80 g/100ml ETOH)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P261-P280-P305+P351+P338
Chemistry & industry
Applications
Uses(2S,3R)-Ethyl 2-amino-3-hydroxybutanoate hydrochloride is a threonine derivative[1].
Suppliers68 total
奥思恩（北京）科技有限公司18201687790 18201687790 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
常州市华阳科技有限公司+8615250961469 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
Related reactions
8 records
Compound notes
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