(2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol

C₆H₁₄O₄ — CID 130718714

About (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol

(2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol (PubChem CID 130718714) has the molecular formula C₆H₁₄O₄ and a molecular weight of 150.17 g/mol. Its IUPAC name is (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol.

Molecular Properties

• Compound Name: (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol
• PubChem CID: 130718714
• Molecular Formula: C₆H₁₄O₄
• Molecular Weight: 150.17 g/mol
• Exact Mass: 150.09
• IUPAC Name: (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol
• SMILES: C[C@](O)(CO)[C@@](C)(O)CO
• InChI: InChI=1S/C6H14O4/c1-5(9,3-7)6(2,10)4-8/h7-10H,3-4H2,1-2H3/t5-,6-/m0/s1
• InChIKey: CAMDLJMITUPAKH-WDSKDSINSA-N
• XLogP: -1.53
• TPSA: 80.92 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 4
• Rotatable Bonds: 3
• Heavy Atoms: 10
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	150.17
LogP ≤ 5	-1.53
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol?

The IUPAC name of (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol (CID 130718714) is (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol.

What is the SMILES notation for (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol?

The canonical SMILES for (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol is C[C@](O)(CO)[C@@](C)(O)CO.

What is the InChIKey of (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol?

The InChIKey is CAMDLJMITUPAKH-WDSKDSINSA-N. The full InChI is InChI=1S/C6H14O4/c1-5(9,3-7)6(2,10)4-8/h7-10H,3-4H2,1-2H3/t5-,6-/m0/s1.

What are the key properties of (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol?

(2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol has a molecular weight of 150.17 g/mol, XLogP of -1.53, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol is sourced from PubChem (CID 130718714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 130718714 — identifiers, structure, computed properties (public domain)

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