ethenoxymethylbenzene

C9H10O — CID 11116115

IUPACethenoxymethylbenzene
SMILESC=COCc1ccccc1
InChIInChI=1S/C9H10O/c1-2-10-8-9-6-4-3-5-7-9/h2-7H,1,8H2
InChIKeyAZDCYKCDXXPQIK-UHFFFAOYSA-N
MW134.18 g/mol
LogP2.35
Rot. Bonds3

About ethenoxymethylbenzene

ethenoxymethylbenzene (PubChem CID 11116115) has the molecular formula C9H10O and a molecular weight of 134.18 g/mol. Its IUPAC name is ethenoxymethylbenzene.

Molecular Properties

Compound Nameethenoxymethylbenzene
PubChem CID11116115
Molecular FormulaC9H10O
Molecular Weight134.18 g/mol
Exact Mass134.07
IUPAC Nameethenoxymethylbenzene
SMILESC=COCc1ccccc1
InChIInChI=1S/C9H10O/c1-2-10-8-9-6-4-3-5-7-9/h2-7H,1,8H2
InChIKeyAZDCYKCDXXPQIK-UHFFFAOYSA-N
XLogP2.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

ethane;ethenoxymethylbenzene
CID 144676673
ethenoxymethylbenzene;ethenyl acetate
CID 70503458
cyclohexylbenzene;ethenoxymethylbenzene
CID 161044898
[4-(ethenoxymethyl)phenyl]methyl benzoate
CID 139924856
[4-(ethenoxymethyl)phenyl]methyl formate
CID 139924907
benzyl 2-ethenoxyethyl carbonate
CID 19813780
2-[[4-(ethenoxymethyl)phenyl]methoxy]-2-oxoacetic acid
CID 139924862
[(3R,4R)-4-phenylmethoxyhexa-1,5-dien-3-yl]oxymethylbenzene
CID 10756228
penta-1,4-dien-3-yloxymethylbenzene
CID 102250646
2,2-difluoroethenoxymethylbenzene
CID 53483110
benzyl N-hydroxymethanimidate
CID 134694398
phenylmethoxymethylidenephosphane
CID 142882655

Frequently Asked Questions

What is the IUPAC name of ethenoxymethylbenzene?
The IUPAC name of ethenoxymethylbenzene (CID 11116115) is ethenoxymethylbenzene.
What is the SMILES notation for ethenoxymethylbenzene?
The canonical SMILES for ethenoxymethylbenzene is C=COCc1ccccc1.
What is the InChIKey of ethenoxymethylbenzene?
The InChIKey is AZDCYKCDXXPQIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O/c1-2-10-8-9-6-4-3-5-7-9/h2-7H,1,8H2.
What are the key properties of ethenoxymethylbenzene?
ethenoxymethylbenzene has a molecular weight of 134.18 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethenoxymethylbenzene is sourced from PubChem (CID 11116115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).