ethane;[(Z)-prop-1-enyl]benzene

C11H16 — CID 90831801

IUPACethane;[(Z)-prop-1-enyl]benzene
SMILESC/C=C\c1ccccc1.CC
InChIInChI=1S/C9H10.C2H6/c1-2-6-9-7-4-3-5-8-9;1-2/h2-8H,1H3;1-2H3/b6-2-;
InChIKeyNVINXWUOGICNLU-FHERWMFHSA-N
MW148.25 g/mol
LogP3.75
Rot. Bonds1

About ethane;[(Z)-prop-1-enyl]benzene

ethane;[(Z)-prop-1-enyl]benzene (PubChem CID 90831801) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is ethane;[(Z)-prop-1-enyl]benzene.

Molecular Properties

Compound Nameethane;[(Z)-prop-1-enyl]benzene
PubChem CID90831801
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Nameethane;[(Z)-prop-1-enyl]benzene
SMILESC/C=C\c1ccccc1.CC
InChIInChI=1S/C9H10.C2H6/c1-2-6-9-7-4-3-5-8-9;1-2/h2-8H,1H3;1-2H3/b6-2-;
InChIKeyNVINXWUOGICNLU-FHERWMFHSA-N
XLogP3.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

CID 157355117
CID 157355117
buta-1,3-diene;bis(prop-1-enylbenzene)
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2-methylprop-1-ene;prop-1-enylbenzene
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prop-1-enylbenzene;thiourea
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(E)-3-phenylprop-2-enal;[(E)-prop-1-enyl]benzene
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2-deuterioethenylbenzene;prop-1-enylbenzene
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ethane;bis(1-phenylpropane-1,2-diol);bis([(E)-prop-1-enyl]benzene)
CID 157286318
propane-1,2-diol;prop-1-enylbenzene
CID 161072622
2,2-dimethylpropanoate;[(E)-prop-1-enyl]benzene;zinc
CID 122206574
[(1E,4E)-hexa-1,4-dienyl]benzene
CID 13068859
CID 70569152
CID 70569152

Frequently Asked Questions

What is the IUPAC name of ethane;[(Z)-prop-1-enyl]benzene?
The IUPAC name of ethane;[(Z)-prop-1-enyl]benzene (CID 90831801) is ethane;[(Z)-prop-1-enyl]benzene.
What is the SMILES notation for ethane;[(Z)-prop-1-enyl]benzene?
The canonical SMILES for ethane;[(Z)-prop-1-enyl]benzene is C/C=C\c1ccccc1.CC.
What is the InChIKey of ethane;[(Z)-prop-1-enyl]benzene?
The InChIKey is NVINXWUOGICNLU-FHERWMFHSA-N. The full InChI is InChI=1S/C9H10.C2H6/c1-2-6-9-7-4-3-5-8-9;1-2/h2-8H,1H3;1-2H3/b6-2-;.
What are the key properties of ethane;[(Z)-prop-1-enyl]benzene?
ethane;[(Z)-prop-1-enyl]benzene has a molecular weight of 148.25 g/mol, XLogP of 3.75, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;[(Z)-prop-1-enyl]benzene is sourced from PubChem (CID 90831801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).