(Z)-8-cyclohex-3-en-1-yloct-6-enal

C14H22O — CID 142978159

IUPAC(Z)-8-cyclohex-3-en-1-yloct-6-enal
SMILESO=CCCCC/C=C\CC1CC=CCC1
InChIInChI=1S/C14H22O/c15-13-9-4-2-1-3-6-10-14-11-7-5-8-12-14/h3,5-7,13-14H,1-2,4,8-12H2/b6-3-
InChIKeyGJRIVGMZTCXGIA-UTCJRWHESA-N
MW206.33 g/mol
LogP4.05
Rot. Bonds7

About (Z)-8-cyclohex-3-en-1-yloct-6-enal

(Z)-8-cyclohex-3-en-1-yloct-6-enal (PubChem CID 142978159) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is (Z)-8-cyclohex-3-en-1-yloct-6-enal.

Molecular Properties

Compound Name(Z)-8-cyclohex-3-en-1-yloct-6-enal
PubChem CID142978159
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name(Z)-8-cyclohex-3-en-1-yloct-6-enal
SMILESO=CCCCC/C=C\CC1CC=CCC1
InChIInChI=1S/C14H22O/c15-13-9-4-2-1-3-6-10-14-11-7-5-8-12-14/h3,5-7,13-14H,1-2,4,8-12H2/b6-3-
InChIKeyGJRIVGMZTCXGIA-UTCJRWHESA-N
XLogP4.05
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-[(E)-pent-2-enyl]cyclohexene
CID 91748880
4-[(Z)-hex-2-en-4-ynyl]cyclohexene
CID 163467133
2-(cyclohex-3-en-1-ylmethyl)prop-2-enal
CID 23066946
buta-1,3-diene;4-(cyclohex-3-en-1-ylmethyl)cyclohexene;4-prop-2-enylcyclohexene
CID 165057381
1-cyclohex-3-en-1-ylbut-3-en-2-one
CID 130029424
(4R)-4-(iodomethyl)cyclohexene
CID 11770032
triaconta-9,17,19-trienedial
CID 54176799
methyl 2-cyclohex-3-en-1-ylacetate
CID 12739784
4-propylcyclohexene
CID 518777
4-(cyclohex-3-en-1-ylmethylamino)-N-cyclopropylbutanamide
CID 79394924
4-[(E)-hex-1-enyl]cyclohexene
CID 12808064
pentadecanedial
CID 22887412

Frequently Asked Questions

What is the IUPAC name of (Z)-8-cyclohex-3-en-1-yloct-6-enal?
The IUPAC name of (Z)-8-cyclohex-3-en-1-yloct-6-enal (CID 142978159) is (Z)-8-cyclohex-3-en-1-yloct-6-enal.
What is the SMILES notation for (Z)-8-cyclohex-3-en-1-yloct-6-enal?
The canonical SMILES for (Z)-8-cyclohex-3-en-1-yloct-6-enal is O=CCCCC/C=C\CC1CC=CCC1.
What is the InChIKey of (Z)-8-cyclohex-3-en-1-yloct-6-enal?
The InChIKey is GJRIVGMZTCXGIA-UTCJRWHESA-N. The full InChI is InChI=1S/C14H22O/c15-13-9-4-2-1-3-6-10-14-11-7-5-8-12-14/h3,5-7,13-14H,1-2,4,8-12H2/b6-3-.
What are the key properties of (Z)-8-cyclohex-3-en-1-yloct-6-enal?
(Z)-8-cyclohex-3-en-1-yloct-6-enal has a molecular weight of 206.33 g/mol, XLogP of 4.05, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-8-cyclohex-3-en-1-yloct-6-enal is sourced from PubChem (CID 142978159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).