Cas no 1536294-99-1 (2-(3-Hydroxy-5-methylthiolan-3-yl)acetic acid)

2-(3-Hydroxy-5-methylthiolan-3-yl)acetic acid structure
1536294-99-1 structure
Product Name:2-(3-Hydroxy-5-methylthiolan-3-yl)acetic acid
CAS No:1536294-99-1
MF:C7H12O3S
MW:176.233381271362
CID:5712703
PubChem ID:79949230
Update Time:2023-10-17

2-(3-Hydroxy-5-methylthiolan-3-yl)acetic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(3-hydroxy-5-methylthiolan-3-yl)aceticacid
    • 2-(3-hydroxy-5-methylthiolan-3-yl)acetic acid
    • AKOS018508832
    • EN300-1296865
    • 1536294-99-1
    • 2-(3-Hydroxy-5-methylthiolan-3-yl)acetic acid
    • Inchi: 1S/C7H12O3S/c1-5-2-7(10,4-11-5)3-6(8)9/h5,10H,2-4H2,1H3,(H,8,9)
    • InChI Key: YNBBWFIDKYPMBF-UHFFFAOYSA-N
    • SMILES: S1CC(CC(=O)O)(CC1C)O

Computed Properties

  • Exact Mass: 176.05071541g/mol
  • Monoisotopic Mass: 176.05071541g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 171
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.7
  • Topological Polar Surface Area: 82.8?2

Experimental Properties

  • Density: 1.297±0.06 g/cm3(Predicted)
  • Boiling Point: 365.6±27.0 °C(Predicted)
  • pka: 4.57±0.10(Predicted)

2-(3-Hydroxy-5-methylthiolan-3-yl)acetic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1296865-1.0g
2-(3-hydroxy-5-methylthiolan-3-yl)acetic acid
1536294-99-1
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$0.0 2023-06-06
Enamine
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$888.0 2023-09-30
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Enamine
EN300-1296865-250mg
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$972.0 2023-09-30
Enamine
EN300-1296865-500mg
2-(3-hydroxy-5-methylthiolan-3-yl)acetic acid
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$1014.0 2023-09-30
Enamine
EN300-1296865-1000mg
2-(3-hydroxy-5-methylthiolan-3-yl)acetic acid
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$1057.0 2023-09-30
Enamine
EN300-1296865-2500mg
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Enamine
EN300-1296865-5000mg
2-(3-hydroxy-5-methylthiolan-3-yl)acetic acid
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$3065.0 2023-09-30
Enamine
EN300-1296865-10000mg
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