4-methyl-5-prop-1-en-2-yloxolan-2-ol

C8H14O2 — CID 14174436

IUPAC4-methyl-5-prop-1-en-2-yloxolan-2-ol
SMILESC=C(C)C1OC(O)CC1C
InChIInChI=1S/C8H14O2/c1-5(2)8-6(3)4-7(9)10-8/h6-9H,1,4H2,2-3H3
InChIKeyDCAWVVJXCNVCJM-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.31
Rot. Bonds1

About 4-methyl-5-prop-1-en-2-yloxolan-2-ol

4-methyl-5-prop-1-en-2-yloxolan-2-ol (PubChem CID 14174436) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 4-methyl-5-prop-1-en-2-yloxolan-2-ol.

Molecular Properties

Compound Name4-methyl-5-prop-1-en-2-yloxolan-2-ol
PubChem CID14174436
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name4-methyl-5-prop-1-en-2-yloxolan-2-ol
SMILESC=C(C)C1OC(O)CC1C
InChIInChI=1S/C8H14O2/c1-5(2)8-6(3)4-7(9)10-8/h6-9H,1,4H2,2-3H3
InChIKeyDCAWVVJXCNVCJM-UHFFFAOYSA-N
XLogP1.31
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

CID 169173785
CID 169173785
oxetane-2,4-diol
CID 20682895
(4S,5S)-5-ethyl-4-methyloxolan-2-ol
CID 59992917
4-methyl-5-propan-2-yloxolan-2-ol
CID 85393181
5-but-3-en-2-yl-4-methyloxolan-2-ol
CID 130150445
(4S,5R)-4-methyl-5-(3-methylbut-2-enyl)oxolan-2-ol
CID 121216137
(1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol
CID 130905987
1-[(2S,3S,4R,6R)-3,4,6-trihydroxyoxan-2-yl]ethanone
CID 143417401
ethane;(2S,5S)-6-(hydroxymethyl)-4-methyloxane-2,5-diol
CID 156740552
2-[(2S,3R,5R)-5-[(4S,5R)-2,2-dimethyl-5-prop-1-en-2-yl-1,3-dioxolan-4-yl]-3-methyloxolan-2-yl]ethanol
CID 11173275
(4R,5R,6S)-4-amino-6-methyloxane-2,5-diol;propan-2-one
CID 141350256
(2R,4S,5R)-4-methyl-5-phenyloxolan-2-ol
CID 130920611

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-prop-1-en-2-yloxolan-2-ol?
The IUPAC name of 4-methyl-5-prop-1-en-2-yloxolan-2-ol (CID 14174436) is 4-methyl-5-prop-1-en-2-yloxolan-2-ol.
What is the SMILES notation for 4-methyl-5-prop-1-en-2-yloxolan-2-ol?
The canonical SMILES for 4-methyl-5-prop-1-en-2-yloxolan-2-ol is C=C(C)C1OC(O)CC1C.
What is the InChIKey of 4-methyl-5-prop-1-en-2-yloxolan-2-ol?
The InChIKey is DCAWVVJXCNVCJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-5(2)8-6(3)4-7(9)10-8/h6-9H,1,4H2,2-3H3.
What are the key properties of 4-methyl-5-prop-1-en-2-yloxolan-2-ol?
4-methyl-5-prop-1-en-2-yloxolan-2-ol has a molecular weight of 142.20 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-prop-1-en-2-yloxolan-2-ol is sourced from PubChem (CID 14174436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).