1-ethenyl-3-(phenylmethoxymethyl)benzene

C16H16O — CID 10443616

IUPAC1-ethenyl-3-(phenylmethoxymethyl)benzene
SMILESC=Cc1cccc(COCc2ccccc2)c1
InChIInChI=1S/C16H16O/c1-2-14-9-6-10-16(11-14)13-17-12-15-7-4-3-5-8-15/h2-11H,1,12-13H2
InChIKeyVCPNLNWALBDQAH-UHFFFAOYSA-N
MW224.30 g/mol
LogP4.05
Rot. Bonds5

About 1-ethenyl-3-(phenylmethoxymethyl)benzene

1-ethenyl-3-(phenylmethoxymethyl)benzene (PubChem CID 10443616) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-ethenyl-3-(phenylmethoxymethyl)benzene.

Molecular Properties

Compound Name1-ethenyl-3-(phenylmethoxymethyl)benzene
PubChem CID10443616
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name1-ethenyl-3-(phenylmethoxymethyl)benzene
SMILESC=Cc1cccc(COCc2ccccc2)c1
InChIInChI=1S/C16H16O/c1-2-14-9-6-10-16(11-14)13-17-12-15-7-4-3-5-8-15/h2-11H,1,12-13H2
InChIKeyVCPNLNWALBDQAH-UHFFFAOYSA-N
XLogP4.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethenyl-3-[2-[2-[(3-ethenylphenyl)methoxy]ethoxymethoxy]ethoxymethyl]benzene
CID 159641511
1-ethenyl-3-(2,2,2-trifluoroethoxymethyl)benzene
CID 86122980
O-[(3-ethenylphenyl)methyl]hydroxylamine
CID 100921787
3-[[3-[[3-[[3-[(3-formylphenyl)methoxymethyl]phenyl]methoxymethyl]phenyl]methoxymethyl]phenyl]methoxymethyl]benzaldehyde
CID 11028483
(3-ethenylphenyl)methylphosphanium chloride
CID 159346927
CID 66734377
CID 66734377
(3-ethenylphenyl)methyl-triphenylphosphanium
CID 22627875
1-ethenyl-4-(phenylmethoxymethoxy)benzene
CID 54554930
3-[(3-ethenylphenyl)methoxy]propyl-diethoxy-methylsilane
CID 139617910
1-ethenyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxymethyl)benzene
CID 100997120
1,3,5-tribromo-2-[(3-ethenylphenyl)methoxy]benzene
CID 139773230
ethane;phenylmethoxymethylbenzene
CID 90943549

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3-(phenylmethoxymethyl)benzene?
The IUPAC name of 1-ethenyl-3-(phenylmethoxymethyl)benzene (CID 10443616) is 1-ethenyl-3-(phenylmethoxymethyl)benzene.
What is the SMILES notation for 1-ethenyl-3-(phenylmethoxymethyl)benzene?
The canonical SMILES for 1-ethenyl-3-(phenylmethoxymethyl)benzene is C=Cc1cccc(COCc2ccccc2)c1.
What is the InChIKey of 1-ethenyl-3-(phenylmethoxymethyl)benzene?
The InChIKey is VCPNLNWALBDQAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-2-14-9-6-10-16(11-14)13-17-12-15-7-4-3-5-8-15/h2-11H,1,12-13H2.
What are the key properties of 1-ethenyl-3-(phenylmethoxymethyl)benzene?
1-ethenyl-3-(phenylmethoxymethyl)benzene has a molecular weight of 224.30 g/mol, XLogP of 4.05, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3-(phenylmethoxymethyl)benzene is sourced from PubChem (CID 10443616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).