(5R)-5-prop-1-en-2-yloxolan-2-one

C7H10O2 — CID 12914394

IUPAC(5R)-5-prop-1-en-2-yloxolan-2-one
SMILESC=C(C)[C@H]1CCC(=O)O1
InChIInChI=1S/C7H10O2/c1-5(2)6-3-4-7(8)9-6/h6H,1,3-4H2,2H3/t6-/m1/s1
InChIKeyPDDNUGGPEBPOIE-ZCFIWIBFSA-N
MW126.16 g/mol
LogP1.27
Rot. Bonds1

About (5R)-5-prop-1-en-2-yloxolan-2-one

(5R)-5-prop-1-en-2-yloxolan-2-one (PubChem CID 12914394) has the molecular formula C7H10O2 and a molecular weight of 126.16 g/mol. Its IUPAC name is (5R)-5-prop-1-en-2-yloxolan-2-one.

Molecular Properties

Compound Name(5R)-5-prop-1-en-2-yloxolan-2-one
PubChem CID12914394
Molecular FormulaC7H10O2
Molecular Weight126.16 g/mol
Exact Mass126.07
IUPAC Name(5R)-5-prop-1-en-2-yloxolan-2-one
SMILESC=C(C)[C@H]1CCC(=O)O1
InChIInChI=1S/C7H10O2/c1-5(2)6-3-4-7(8)9-6/h6H,1,3-4H2,2H3/t6-/m1/s1
InChIKeyPDDNUGGPEBPOIE-ZCFIWIBFSA-N
XLogP1.27
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-(1-chloro-2-methylprop-1-enyl)oxolan-2-one
CID 13416543
methyl 5-oxooxolane-2-carboxylate
CID 558879
5-acetyloxolan-2-one;oxolan-2-one
CID 70146816
5-(2-hydroxyacetyl)oxolan-2-one
CID 69254200
(5S)-5-(3-methylbutanoyl)oxolan-2-one
CID 157301078
(5S)-5-undecanoyloxolan-2-one
CID 10800956
N-[(1R)-1-iodoethyl]-5-oxooxolane-2-carboxamide
CID 153078842
5-methyloxolan-2-one
CID 69397003
3-methylidene-5-prop-1-en-2-yloxolan-2-one
CID 14714230
(2S)-N-cyclooctyl-5-oxooxolane-2-carboxamide
CID 97015821
5-oxo-N-(4-oxocyclohexyl)oxolane-2-carboxamide
CID 77230935
2-[(10Z)-7-methyl-14-oxo-2-prop-1-en-2-yl-1-oxacyclotetradec-10-en-4-yl]prop-2-enoic acid
CID 169192198

Frequently Asked Questions

What is the IUPAC name of (5R)-5-prop-1-en-2-yloxolan-2-one?
The IUPAC name of (5R)-5-prop-1-en-2-yloxolan-2-one (CID 12914394) is (5R)-5-prop-1-en-2-yloxolan-2-one.
What is the SMILES notation for (5R)-5-prop-1-en-2-yloxolan-2-one?
The canonical SMILES for (5R)-5-prop-1-en-2-yloxolan-2-one is C=C(C)[C@H]1CCC(=O)O1.
What is the InChIKey of (5R)-5-prop-1-en-2-yloxolan-2-one?
The InChIKey is PDDNUGGPEBPOIE-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H10O2/c1-5(2)6-3-4-7(8)9-6/h6H,1,3-4H2,2H3/t6-/m1/s1.
What are the key properties of (5R)-5-prop-1-en-2-yloxolan-2-one?
(5R)-5-prop-1-en-2-yloxolan-2-one has a molecular weight of 126.16 g/mol, XLogP of 1.27, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-prop-1-en-2-yloxolan-2-one is sourced from PubChem (CID 12914394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).