(2R)-3-sulfanylpropane-1,2-diol
Basic information
- CAS
16495-21-9- Standard SMILES
OC[C@@H](O)CS- InChIKey
PJUIMOJAAPLTRJ-GSVOUGTGSA-N- Molecular formula
- C3H8O2S
- Average molar mass
- 108.16 g/mol
- Monoisotopic mass
- 108.02450067
Overview
(R)-monothioglycerol is a monothioglycerol that has R configuration.
Names & identifiers
- Preferred name
- (2R)-3-sulfanylpropane-1,2-diol
- IUPAC
- (2R)-3-sulfanylpropane-1,2-diol
Names & synonyms
(2R)-3-sulfanylpropane-1,2-diol16495-21-9DTXSID00332257RefChem:397357GlyTouCan:G03208DSDTXCID00283351G03208DS874-197-4(R)-3-mercaptopropane-1,2-diol1,2-Propanediol, 3-mercapto-, (2R)-(R)?-?3-?Mercaptopropane-?1,?2-?diol(2R)-3-Mercapto-1,2-propanediol
Show more names
D-1-thioglycerol(R)-monothioglycerolSCHEMBL4463SCHEMBL4421250CHEBI:45619R-(-)-3-mercapto-1,2-propanediolDB03864(-)-(R)-3-mercapto-1,2-propanediol
Database identifiers
- CAS
16495-21-9- PubChem CID
- 447638
- DTXSID
DTXSID00332257- ChEBI
CHEBI:45619- EC Number
- 874-197-4
- Nikkaji
- J1.216.745H
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 32
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, 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%)
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Related reactions
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Compound notes
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