2-[(Z)-hex-3-enoxy]ethenylbenzene

C14H18O — CID 155674734

IUPAC2-[(Z)-hex-3-enoxy]ethenylbenzene
SMILESCC/C=C\CCOC=Cc1ccccc1
InChIInChI=1S/C14H18O/c1-2-3-4-8-12-15-13-11-14-9-6-5-7-10-14/h3-7,9-11,13H,2,8,12H2,1H3/b4-3-,13-11?
InChIKeyWXSSNALYWZGWOT-RUEQXHNJSA-N
MW202.30 g/mol
LogP4.03
Rot. Bonds6

About 2-[(Z)-hex-3-enoxy]ethenylbenzene

2-[(Z)-hex-3-enoxy]ethenylbenzene (PubChem CID 155674734) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-[(Z)-hex-3-enoxy]ethenylbenzene.

Molecular Properties

Compound Name2-[(Z)-hex-3-enoxy]ethenylbenzene
PubChem CID155674734
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name2-[(Z)-hex-3-enoxy]ethenylbenzene
SMILESCC/C=C\CCOC=Cc1ccccc1
InChIInChI=1S/C14H18O/c1-2-3-4-8-12-15-13-11-14-9-6-5-7-10-14/h3-7,9-11,13H,2,8,12H2,1H3/b4-3-,13-11?
InChIKeyWXSSNALYWZGWOT-RUEQXHNJSA-N
XLogP4.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(Z)-hex-3-enyl] 2-(2-phenylethenoxy)propanoate
CID 167437987
benzene;but-1-enylbenzene
CID 157481332
2-(2-chloroethoxy)ethenylbenzene
CID 54340888
[(E)-3-[(E)-but-1-enoxy]prop-1-enyl]benzene
CID 10726289
[(E)-2-(2-methylsulfanylethoxy)ethenyl]benzene
CID 10821658
1-[(Z)-hex-3-enoxy]prop-1-en-2-ylbenzene
CID 155674731
4-phenylbut-3-enyl formate
CID 91350820
2-(2-ethoxyethoxy)ethenylbenzene;2-phenylethenol
CID 70115763
but-1-enylbenzene;phenoxybenzene
CID 175609674
2-(chloromethoxy)ethenylbenzene
CID 54484183
[(1E,4Z,6Z)-nona-1,4,6-trienyl]benzene
CID 142095527
2-(3-methylpent-2-enoxy)ethenylbenzene
CID 170558651

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-hex-3-enoxy]ethenylbenzene?
The IUPAC name of 2-[(Z)-hex-3-enoxy]ethenylbenzene (CID 155674734) is 2-[(Z)-hex-3-enoxy]ethenylbenzene.
What is the SMILES notation for 2-[(Z)-hex-3-enoxy]ethenylbenzene?
The canonical SMILES for 2-[(Z)-hex-3-enoxy]ethenylbenzene is CC/C=C\CCOC=Cc1ccccc1.
What is the InChIKey of 2-[(Z)-hex-3-enoxy]ethenylbenzene?
The InChIKey is WXSSNALYWZGWOT-RUEQXHNJSA-N. The full InChI is InChI=1S/C14H18O/c1-2-3-4-8-12-15-13-11-14-9-6-5-7-10-14/h3-7,9-11,13H,2,8,12H2,1H3/b4-3-,13-11?.
What are the key properties of 2-[(Z)-hex-3-enoxy]ethenylbenzene?
2-[(Z)-hex-3-enoxy]ethenylbenzene has a molecular weight of 202.30 g/mol, XLogP of 4.03, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-hex-3-enoxy]ethenylbenzene is sourced from PubChem (CID 155674734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).