ethyl rac-(2R)-2-amino-3-methylsulfanyl-propanoate;hydrochloride
Basic information
- CAS
792132-38-8- Standard SMILES
CCOC(=O)C(N)CSC- InChIKey
SOUTVWYPVSFHNV-YFKPBYRVSA-N- Molecular formula
- C6H13NO2S
- Average molar mass
- 163.24 g/mol
- Monoisotopic mass
- 163.06669983
Names & identifiers
- Preferred name
- ethyl rac-(2R)-2-amino-3-methylsulfanyl-propanoate;hydrochloride
- IUPAC
- ethyl 2-amino-3-methylsulfanylpropanoate
- English name
- Cysteine, S-methyl-, ethyl ester
- Molecular formula
- C6H13NO2S
- Molecular weight
- 0
Names & synonyms
792132-38-8RefChem:596397ethyl rac-(2R)-2-amino-3-methylsulfanyl-propanoate;hydrochloride881-648-9Ethyl 2-amino-3-(methylsulfanyl)propanoateS-Methylcysteine, ethyl esterSCHEMBL11739657SOUTVWYPVSFHNV-UHFFFAOYSA-NAKOS011222739Ethyl 2-amino-3-(methylsulfanyl)propanoate #EN300-396031Cysteine, S-methyl-, ethyl ester
Database identifiers
- CAS
792132-38-8- PubChem CID
- 428291
- EC Number
- 881-648-9
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 77.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 108
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335-H302
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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Related reactions
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Compound notes
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