(3S)-2-methyloxolane-2,3-diol

C5H10O3 — CID 134855830

IUPAC(3S)-2-methyloxolane-2,3-diol
SMILESCC1(O)OCC[C@@H]1O
InChIInChI=1S/C5H10O3/c1-5(7)4(6)2-3-8-5/h4,6-7H,2-3H2,1H3/t4-,5?/m0/s1
InChIKeyUUVNJWZKAZUKIG-ROLXFIACSA-N
MW118.13 g/mol
LogP-0.52
Rot. Bonds

About (3S)-2-methyloxolane-2,3-diol

(3S)-2-methyloxolane-2,3-diol (PubChem CID 134855830) has the molecular formula C5H10O3 and a molecular weight of 118.13 g/mol. Its IUPAC name is (3S)-2-methyloxolane-2,3-diol.

Molecular Properties

Compound Name(3S)-2-methyloxolane-2,3-diol
PubChem CID134855830
Molecular FormulaC5H10O3
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Name(3S)-2-methyloxolane-2,3-diol
SMILESCC1(O)OCC[C@@H]1O
InChIInChI=1S/C5H10O3/c1-5(7)4(6)2-3-8-5/h4,6-7H,2-3H2,1H3/t4-,5?/m0/s1
InChIKeyUUVNJWZKAZUKIG-ROLXFIACSA-N
XLogP-0.52
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-2,2-dimethyloxolan-3-ol
CID 13327311
(2S,4S)-2-tert-butyl-3,3-difluorooxane-2,4-diol
CID 132603402
(3S)-2-methyl-3-phosphanyloxyoxolan-2-ol
CID 118151835
CID 58183500
CID 58183500
2,2-diethyloxolan-3-ol
CID 130122256
8-methyl-1-oxaspiro[4.5]decan-4-ol
CID 165460005
2-methyl-5-oxa-2-azaspiro[3.4]octan-8-ol
CID 146666678
2,3-dimethyl-1,4-oxathian-2-ol
CID 58183588
(4S)-1-oxaspiro[4.5]decan-4-ol
CID 134985958
(4S)-4-methyl-2-(trifluoromethyl)oxan-2-ol
CID 59705891
(2R)-1-methylcyclobutane-1,2-diol
CID 130694777
(4R)-3,3,4-trihydroxyoxan-2-one
CID 89299537

Frequently Asked Questions

What is the IUPAC name of (3S)-2-methyloxolane-2,3-diol?
The IUPAC name of (3S)-2-methyloxolane-2,3-diol (CID 134855830) is (3S)-2-methyloxolane-2,3-diol.
What is the SMILES notation for (3S)-2-methyloxolane-2,3-diol?
The canonical SMILES for (3S)-2-methyloxolane-2,3-diol is CC1(O)OCC[C@@H]1O.
What is the InChIKey of (3S)-2-methyloxolane-2,3-diol?
The InChIKey is UUVNJWZKAZUKIG-ROLXFIACSA-N. The full InChI is InChI=1S/C5H10O3/c1-5(7)4(6)2-3-8-5/h4,6-7H,2-3H2,1H3/t4-,5?/m0/s1.
What are the key properties of (3S)-2-methyloxolane-2,3-diol?
(3S)-2-methyloxolane-2,3-diol has a molecular weight of 118.13 g/mol, XLogP of -0.52, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-2-methyloxolane-2,3-diol is sourced from PubChem (CID 134855830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).