(1-ethenyl-1-phenylprop-2-enoxy)benzene

C17H16O — CID 67928175

IUPAC(1-ethenyl-1-phenylprop-2-enoxy)benzene
SMILESC=CC(C=C)(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C17H16O/c1-3-17(4-2,15-11-7-5-8-12-15)18-16-13-9-6-10-14-16/h3-14H,1-2H2
InChIKeyNGVKCSLSZFSJIQ-UHFFFAOYSA-N
MW236.31 g/mol
LogP4.33
Rot. Bonds5

About (1-ethenyl-1-phenylprop-2-enoxy)benzene

(1-ethenyl-1-phenylprop-2-enoxy)benzene (PubChem CID 67928175) has the molecular formula C17H16O and a molecular weight of 236.31 g/mol. Its IUPAC name is (1-ethenyl-1-phenylprop-2-enoxy)benzene.

Molecular Properties

Compound Name(1-ethenyl-1-phenylprop-2-enoxy)benzene
PubChem CID67928175
Molecular FormulaC17H16O
Molecular Weight236.31 g/mol
Exact Mass236.12
IUPAC Name(1-ethenyl-1-phenylprop-2-enoxy)benzene
SMILESC=CC(C=C)(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C17H16O/c1-3-17(4-2,15-11-7-5-8-12-15)18-16-13-9-6-10-14-16/h3-14H,1-2H2
InChIKeyNGVKCSLSZFSJIQ-UHFFFAOYSA-N
XLogP4.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 54.33
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

(1,2-diphenoxy-1,2,2-triphenylethyl)benzene
CID 10164874
2-ethenyl-2-phenoxypropanedinitrile
CID 91584701
2-ethenyl-2-phenylbut-3-enamide
CID 121008159
1-(1-amino-1-phenylprop-2-enoxy)-1-phenylprop-2-en-1-amine
CID 67646967
1,1-diphenylprop-2-enyl(ethenyl)silane
CID 173024270
2-cyano-2-phenoxy-2-phenylacetic acid
CID 66769789
triiodomethoxybenzene
CID 70252618
ethane;methane;(2-methylpropan-2-yl)oxybenzene
CID 159885563
1,1-dichloroprop-2-enylbenzene
CID 23350286
(3,4-dimethyl-4-phenylhexa-1,5-dien-3-yl)benzene
CID 166095951
ethane;methane;(2-methylpropan-2-yl)oxybenzene
CID 161423888
3-phenoxyhex-1-en-3-ol
CID 69380942

Frequently Asked Questions

What is the IUPAC name of (1-ethenyl-1-phenylprop-2-enoxy)benzene?
The IUPAC name of (1-ethenyl-1-phenylprop-2-enoxy)benzene (CID 67928175) is (1-ethenyl-1-phenylprop-2-enoxy)benzene.
What is the SMILES notation for (1-ethenyl-1-phenylprop-2-enoxy)benzene?
The canonical SMILES for (1-ethenyl-1-phenylprop-2-enoxy)benzene is C=CC(C=C)(Oc1ccccc1)c1ccccc1.
What is the InChIKey of (1-ethenyl-1-phenylprop-2-enoxy)benzene?
The InChIKey is NGVKCSLSZFSJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O/c1-3-17(4-2,15-11-7-5-8-12-15)18-16-13-9-6-10-14-16/h3-14H,1-2H2.
What are the key properties of (1-ethenyl-1-phenylprop-2-enoxy)benzene?
(1-ethenyl-1-phenylprop-2-enoxy)benzene has a molecular weight of 236.31 g/mol, XLogP of 4.33, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethenyl-1-phenylprop-2-enoxy)benzene is sourced from PubChem (CID 67928175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).