(2Z)-deca-2,4-dienal

C10H16O — CID 87792972

IUPAC(2Z)-deca-2,4-dienal
SMILESCCCCCC=C/C=C\C=O
InChIInChI=1S/C10H16O/c1-2-3-4-5-6-7-8-9-10-11/h6-10H,2-5H2,1H3/b7-6?,9-8-
InChIKeyJZQKTMZYLHNFPL-JZQWERLISA-N
MW152.24 g/mol
LogP2.88
Rot. Bonds6

About (2Z)-deca-2,4-dienal

(2Z)-deca-2,4-dienal (PubChem CID 87792972) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (2Z)-deca-2,4-dienal.

Molecular Properties

Compound Name(2Z)-deca-2,4-dienal
PubChem CID87792972
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(2Z)-deca-2,4-dienal
SMILESCCCCCC=C/C=C\C=O
InChIInChI=1S/C10H16O/c1-2-3-4-5-6-7-8-9-10-11/h6-10H,2-5H2,1H3/b7-6?,9-8-
InChIKeyJZQKTMZYLHNFPL-JZQWERLISA-N
XLogP2.88
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.88
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': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

icosa-2,4,6-trienal
CID 54359003
(2Z,4E)-heptadeca-2,4-dienal
CID 167495571
(2E,4E)-dodeca-2,4-dienal
CID 5367530
deca-2,4-dienal;ethanol
CID 173139337
(E)-non-2-enal
CID 160680674
(E)-non-2-enal
CID 5283335
(E)-dec-2-enal
CID 5283345
dodec-2-enal;(E)-hex-2-enal
CID 159709120
pentadeca-2,7-dienal
CID 140791013
(4E)-octa-2,4-dienal
CID 175603405
(2Z,4E)-octadeca-2,4,6,15-tetraenal
CID 175749162
(22E)-heptatetraconta-22,24-diene
CID 56629131

Frequently Asked Questions

What is the IUPAC name of (2Z)-deca-2,4-dienal?
The IUPAC name of (2Z)-deca-2,4-dienal (CID 87792972) is (2Z)-deca-2,4-dienal.
What is the SMILES notation for (2Z)-deca-2,4-dienal?
The canonical SMILES for (2Z)-deca-2,4-dienal is CCCCCC=C/C=C\C=O.
What is the InChIKey of (2Z)-deca-2,4-dienal?
The InChIKey is JZQKTMZYLHNFPL-JZQWERLISA-N. The full InChI is InChI=1S/C10H16O/c1-2-3-4-5-6-7-8-9-10-11/h6-10H,2-5H2,1H3/b7-6?,9-8-.
What are the key properties of (2Z)-deca-2,4-dienal?
(2Z)-deca-2,4-dienal has a molecular weight of 152.24 g/mol, XLogP of 2.88, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-deca-2,4-dienal is sourced from PubChem (CID 87792972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).