4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane

C17H24O2 — CID 6374281

IUPAC4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane
SMILESCCCCC/C(=C/c1ccccc1)C1OCC(C)O1
InChIInChI=1S/C17H24O2/c1-3-4-6-11-16(17-18-13-14(2)19-17)12-15-9-7-5-8-10-15/h5,7-10,12,14,17H,3-4,6,11,13H2,1-2H3/b16-12-
InChIKeyZPFONCVCIDIULW-VBKFSLOCSA-N
MW260.38 g/mol
LogP4.41
Rot. Bonds6

About 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane

4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane (PubChem CID 6374281) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane.

Molecular Properties

Compound Name4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane
PubChem CID6374281
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Name4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane
SMILESCCCCC/C(=C/c1ccccc1)C1OCC(C)O1
InChIInChI=1S/C17H24O2/c1-3-4-6-11-16(17-18-13-14(2)19-17)12-15-9-7-5-8-10-15/h5,7-10,12,14,17H,3-4,6,11,13H2,1-2H3/b16-12-
InChIKeyZPFONCVCIDIULW-VBKFSLOCSA-N
XLogP4.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[(E)-1-phenylhept-1-en-2-yl]-1,3-dioxolan-4-yl]methyl acetate
CID 6296253
[(E)-2-fluorohept-1-enyl]benzene
CID 20721098
2-(chloromethyl)oct-1-enylbenzene
CID 69226716
(2E)-2-benzylideneheptanoic acid
CID 14318164
[(Z)-2-chlorooct-1-enyl]benzene
CID 15271116
propane;[(E)-2-prop-1-en-2-ylhept-1-enyl]benzene
CID 143966502
2-benzylideneicosanamide
CID 167436455
[(Z)-2-ethoxynon-1-enyl]benzene
CID 134932446
(E)-2-methyl-1-phenylnon-1-en-3-one
CID 102243478
(NZ)-N-[(2E)-2-benzylideneheptylidene]hydroxylamine
CID 5356023
(Z)-1-(butylamino)-2-phenylethenol
CID 134892949
[(E)-1-phenylhex-1-en-2-yl]benzene
CID 11791205

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane?
The IUPAC name of 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane (CID 6374281) is 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane.
What is the SMILES notation for 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane?
The canonical SMILES for 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane is CCCCC/C(=C/c1ccccc1)C1OCC(C)O1.
What is the InChIKey of 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane?
The InChIKey is ZPFONCVCIDIULW-VBKFSLOCSA-N. The full InChI is InChI=1S/C17H24O2/c1-3-4-6-11-16(17-18-13-14(2)19-17)12-15-9-7-5-8-10-15/h5,7-10,12,14,17H,3-4,6,11,13H2,1-2H3/b16-12-.
What are the key properties of 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane?
4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane has a molecular weight of 260.38 g/mol, XLogP of 4.41, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[(Z)-1-phenylhept-1-en-2-yl]-1,3-dioxolane is sourced from PubChem (CID 6374281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).