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

C6H14O4 — CID 130718714

IUPAC(2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol
SMILESC[C@](O)(CO)[C@@](C)(O)CO
InChIInChI=1S/C6H14O4/c1-5(9,3-7)6(2,10)4-8/h7-10H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKeyCAMDLJMITUPAKH-WDSKDSINSA-N
MW150.17 g/mol
LogP-1.53
Rot. Bonds3

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 CID130718714
Molecular FormulaC6H14O4
Molecular Weight150.17 g/mol
Exact Mass150.09
IUPAC Name(2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol
SMILESC[C@](O)(CO)[C@@](C)(O)CO
InChIInChI=1S/C6H14O4/c1-5(9,3-7)6(2,10)4-8/h7-10H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKeyCAMDLJMITUPAKH-WDSKDSINSA-N
XLogP-1.53
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.17
LogP ≤ 5-1.53
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dimethylbutane-1,2,3,4-tetrol
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2-silylpropane-1,2-diol
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3,4,5,6-tetrahydroxy-3,4,5-trimethylhexan-2-one
CID 23565497
2,4-bis(hydroxymethyl)-3-methyl-3-(1,2,3-trihydroxypropan-2-yl)pentane-1,2,4,5-tetrol
CID 175345676
alumane;2,2-dimethylpropan-1-ol
CID 174479314
2-(hydroxymethyl)-2-methylpropane-1,3-diol
CID 118432348
3,3,3-trifluoro-2,2-dimethylpropan-1-ol
CID 59951355
3,3,3-trifluoro-2-(trideuteriomethyl)propane-1,2-diol
CID 162760770
ethane-1,1,1,2-tetrol
CID 22259953
sodium;2,2-dimethylpropan-1-ol;hydride
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CID 88666778

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).