1-ethoxy-4-[(Z)-prop-1-enoxy]benzene

C11H14O2 — CID 101144110

IUPAC1-ethoxy-4-[(Z)-prop-1-enoxy]benzene
SMILESC/C=C\Oc1ccc(OCC)cc1
InChIInChI=1S/C11H14O2/c1-3-9-13-11-7-5-10(6-8-11)12-4-2/h3,5-9H,4H2,1-2H3/b9-3-
InChIKeyADJYWIRUWWXPBD-OQFOIZHKSA-N
MW178.23 g/mol
LogP3.00
Rot. Bonds4

About 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene

1-ethoxy-4-[(Z)-prop-1-enoxy]benzene (PubChem CID 101144110) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene.

Molecular Properties

Compound Name1-ethoxy-4-[(Z)-prop-1-enoxy]benzene
PubChem CID101144110
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name1-ethoxy-4-[(Z)-prop-1-enoxy]benzene
SMILESC/C=C\Oc1ccc(OCC)cc1
InChIInChI=1S/C11H14O2/c1-3-9-13-11-7-5-10(6-8-11)12-4-2/h3,5-9H,4H2,1-2H3/b9-3-
InChIKeyADJYWIRUWWXPBD-OQFOIZHKSA-N
XLogP3.00
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-ethoxy-4-[(E)-pent-3-enyl]benzene
CID 22095339
1-ethoxy-4-(fluoromethoxy)benzene
CID 21036002
1-ethoxy-4-[(Z)-hex-4-en-2-yl]benzene
CID 83932237
1-N,4-N-bis(4-ethoxyphenyl)benzene-1,4-diamine
CID 139791472
ethane;1-ethoxy-4-fluorobenzene
CID 143106824
tetrakis(4-ethoxyphenyl)boranuide
CID 11071374
ethoxybenzene chloride
CID 21193593
1-ethoxy-4-(2-phenylethenyl)benzene
CID 54277622
(4-ethoxyphenyl)-oxosulfanium
CID 174263309
1-(2,2-dimethylpropoxy)-4-ethoxybenzene
CID 170603637
1-ethoxy-4-ethoxybenzene
CID 91392612
4-ethoxy-N,N-dimethylaniline
CID 3624890

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene?
The IUPAC name of 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene (CID 101144110) is 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene.
What is the SMILES notation for 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene?
The canonical SMILES for 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene is C/C=C\Oc1ccc(OCC)cc1.
What is the InChIKey of 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene?
The InChIKey is ADJYWIRUWWXPBD-OQFOIZHKSA-N. The full InChI is InChI=1S/C11H14O2/c1-3-9-13-11-7-5-10(6-8-11)12-4-2/h3,5-9H,4H2,1-2H3/b9-3-.
What are the key properties of 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene?
1-ethoxy-4-[(Z)-prop-1-enoxy]benzene has a molecular weight of 178.23 g/mol, XLogP of 3.00, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-4-[(Z)-prop-1-enoxy]benzene is sourced from PubChem (CID 101144110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).