4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene

C18H18O — CID 155642904

IUPAC4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene
SMILESC=CCOc1ccc(-c2ccccc2)cc1CC=C
InChIInChI=1S/C18H18O/c1-3-8-17-14-16(15-9-6-5-7-10-15)11-12-18(17)19-13-4-2/h3-7,9-12,14H,1-2,8,13H2
InChIKeyFTWVVHCDAZTKLV-UHFFFAOYSA-N
MW250.34 g/mol
LogP4.65
Rot. Bonds6

About 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene

4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene (PubChem CID 155642904) has the molecular formula C18H18O and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene.

Molecular Properties

Compound Name4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene
PubChem CID155642904
Molecular FormulaC18H18O
Molecular Weight250.34 g/mol
Exact Mass250.14
IUPAC Name4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene
SMILESC=CCOc1ccc(-c2ccccc2)cc1CC=C
InChIInChI=1S/C18H18O/c1-3-8-17-14-16(15-9-6-5-7-10-15)11-12-18(17)19-13-4-2/h3-7,9-12,14H,1-2,8,13H2
InChIKeyFTWVVHCDAZTKLV-UHFFFAOYSA-N
XLogP4.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(4-phenyl-2-prop-2-enylphenoxy)acetohydrazide
CID 54848554
4-phenylmethoxy-1-prop-2-enoxy-2-prop-2-enylbenzene
CID 22261130
dipotassium;3-bromoprop-1-ene;hydride;4-(4-hydroxy-3-prop-2-enylphenyl)-2-prop-2-enylphenol;oxido formate;1-prop-2-enoxy-4-(4-prop-2-enoxy-3-prop-2-enylphenyl)-2-prop-2-enylbenzene
CID 160572583
4-ethoxy-1-prop-2-enoxy-2-prop-2-enylbenzene
CID 24770219
2-amino-6-oxo-4-(4-prop-2-enoxy-3-prop-2-enylphenyl)-1H-pyridine-3,5-dicarboxylic acid
CID 169406482
2-prop-2-enoxy-1,4-bis(prop-2-enyl)benzene
CID 66892127
methyl 4-prop-2-enoxy-3-prop-2-enylbenzoate
CID 11241748
3-benzyl-4-prop-2-enoxybenzaldehyde
CID 130337135
1-prop-2-enoxy-2-[(2-prop-2-enoxyphenyl)methoxymethyl]benzene
CID 102306683
(2-prop-2-enoxyphenyl)methanol
CID 11137475
4-[(E)-but-2-enoxy]-3-prop-2-enylaniline
CID 107898642
2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene
CID 174804005

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene?
The IUPAC name of 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene (CID 155642904) is 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene.
What is the SMILES notation for 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene?
The canonical SMILES for 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene is C=CCOc1ccc(-c2ccccc2)cc1CC=C.
What is the InChIKey of 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene?
The InChIKey is FTWVVHCDAZTKLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O/c1-3-8-17-14-16(15-9-6-5-7-10-15)11-12-18(17)19-13-4-2/h3-7,9-12,14H,1-2,8,13H2.
What are the key properties of 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene?
4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene has a molecular weight of 250.34 g/mol, XLogP of 4.65, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1-prop-2-enoxy-2-prop-2-enylbenzene is sourced from PubChem (CID 155642904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).