Basic information
- CAS
52605-49-9- Standard SMILES
CCOC(=O)CNC.Cl- InChIKey
NIDZUMSLERGAON-UHFFFAOYSA-N- Molecular formula
- C5H12ClNO2
- Average molar mass
- 153.61 g/mol
- Monoisotopic mass
- 153.0556563
Names & identifiers
- Preferred name
- Ethyl N-methylaminoacetate hydrochloride
- IUPAC
- ethyl 2-(methylamino)acetate;hydrochloride
- English name
- Ethyl sarcosinate hydrochloride
- Molecular formula
- C5H12ClNO2
- Molecular weight
- 153.61
Names & synonyms
Ethyl N-methylaminoacetate hydrochlorideGlycine, N-methyl-, ethyl ester, hydrochlorideEthyl N-methylaminoacetate HClEINECS 258-037-5DTXSID00200588NSC 100148RefChem:596334DTXCID30123079258-037-552605-49-9Sarcosine ethyl ester hydrochlorideEthyl sarcosinate hydrochloride
Show more names
H-SAR-OET·HCLEthyl sarcosinate HCLethyl methylglycinate hydrochlorideSAR-OET HCLH-SAR-OE HCLL-Sar-OEt·HClH-SAR-OET HCL
H-Sar-OEt.Hclethyl 2-(methylamino)acetate hydrochloridesarcosine ethyl ester HClMFCD00012506ethyl 2-(methylamino)acetate;hydrochlorideSCHEMBL394409Ethyl 2-(methylamino)acetate HClsarcosine ethyl ester hydrochloride salt
Database identifiers
- CAS
52605-49-9- PubChem CID
- 171173
- DTXSID
DTXSID00200588- EC Number
- 258-037-5
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 72.8
Experimental & physicochemical properties
Chemical ClassesBiological Agents -> Amino Acids and Derivatives
Physical DescriptionWhite hygroscopic crystalline powder; [Acros Organics MSDS]
Physicochemical properties
- Melting point
- 125 °C · ~125 °C
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- 2 O: · H2O: 0.1 g/mL, clear
- form
- Crystalline Powder
- color
- White to off-white
- Water Solubility
- 0.1 g/mL · Soluble in water 0.1 g/mL.
- Sensitive
- Hygroscopic
- BRN
- 3911182 · 3911182
- Major Application
- peptide synthesis
- InChI
- InChI=1S/C5H11NO2.ClH/c1-3-8-5(7)4-6-2;/h6H,3-4H2,1-2H3;1H
- InChIKey
- NIDZUMSLERGAON-UHFFFAOYSA-N
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
This chemical does not meet GHS hazard criteria for 40% (2 of 5) of reports.
Warning
H315 (60%): 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 5 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Status: Active Update: 29-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/25562
Glycine, N-methyl-, ethyl ester, hydrochloride: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryMay cause irritation; [Acros Organics MSDS] See Sarcosine.
Hazard Classes and CategoriesSkin Irrit. 2 (60%)
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 29299090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesSarcosine ethyl ester hydrochloride is a metabolite of Sarcosine (S140500), which as been found in starfish and sea urchins. It is used as intermediate in the synthesis of antienzyme agents for toothpaste. Found to be a marker for prostate cancer bioagression.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
扬州旭达生物科技有限公司15161820588; 15161820588 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Related reactions
110 records
Compound notes
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