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(2S)-2-Mercaptopropanoic Acid

CAT: 0572-TRC-M202725-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M202725-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
57965-30-7
Synonyms
(-)-2-Mercaptopropionic Acid; 2(S)-Mercaptopropanoic Acid;
Hazard Statement
No Data Available
Smiles
C[C@H](S)C(=O)O
Molecular Formula
C3H6O2S
Molecular Weight
106.14
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

(2S)-2-Hydroxypropanethioic S-acid
CAS Number57965-30-7
PubChem CID21115383
IUPAC Name(2S)-2-hydroxypropanethioic S-acid
Molecular FormulaC3H6O2S
Molecular Weight106.15
XLogP0
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count6
Formal Charge0
Complexity61
SMILES
C[C@@H](C(=O)S)O
InChI
InChI=1S/C3H6O2S/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m0/s1
InChIKey
UKGVIOAJJOUOII-REOHCLBHSA-N
Chemical Structure
2D Structure
2D structure of (2S)-2-Hydroxypropanethioic S-acid
CAS: 57965-30-7
CID: 21115383
Formula: C3H6O2S
MW: 106.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight106.15
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass106.00885060
Monoisotopic Mass106.00885060
Topological Polar Surface Area38.3 Ų
Heavy Atom Count6
Formal Charge0
Complexity61.8
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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