(Z)-5-ethenyl-6-iododec-5-ene

C12H21I — CID 15211599

IUPAC(Z)-5-ethenyl-6-iododec-5-ene
SMILESC=C/C(CCCC)=C(\I)CCCC
InChIInChI=1S/C12H21I/c1-4-7-9-11(6-3)12(13)10-8-5-2/h6H,3-5,7-10H2,1-2H3/b12-11+
InChIKeyINUQNUZTSAFVIS-VAWYXSNFSA-N
MW292.20 g/mol
LogP5.24
Rot. Bonds7

About (Z)-5-ethenyl-6-iododec-5-ene

(Z)-5-ethenyl-6-iododec-5-ene (PubChem CID 15211599) has the molecular formula C12H21I and a molecular weight of 292.20 g/mol. Its IUPAC name is (Z)-5-ethenyl-6-iododec-5-ene.

Molecular Properties

Compound Name(Z)-5-ethenyl-6-iododec-5-ene
PubChem CID15211599
Molecular FormulaC12H21I
Molecular Weight292.20 g/mol
Exact Mass292.07
IUPAC Name(Z)-5-ethenyl-6-iododec-5-ene
SMILESC=C/C(CCCC)=C(\I)CCCC
InChIInChI=1S/C12H21I/c1-4-7-9-11(6-3)12(13)10-8-5-2/h6H,3-5,7-10H2,1-2H3/b12-11+
InChIKeyINUQNUZTSAFVIS-VAWYXSNFSA-N
XLogP5.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.20
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

1-[(E)-2-iodoethenyl]cyclohexene
CID 10879043
1-Butyl-6-iodocyclohepta-1,3,5-triene
CID 12752699
(3Z)-3-methylnona-1,3-diene
CID 13382654
(3E)-2-methylnona-1,3-diene
CID 14028240
Dimethyl nonadiene
CID 53762143
4,5-Diethyl-3,6-diiodoocta-3,5-diene
CID 71339615
Dimethylundecatriene
CID 129773361
1,3,5-Undecatriene, 2-methyl-, (3E,5E)-
CID 6365726
1,3,5-Undecatriene, 2-methyl-, (3E,5Z)-
CID 20836186
(Z)-1-fluoro-4-[(Z)-2-iodoethenyl]oct-3-ene
CID 89742976
(2Z,4Z)-8-fluoro-8-iodo-4-methyl-6-methylidenenona-2,4-diene
CID 167100998
(1Z,4Z)-5-ethyl-1-fluoro-1-iodo-4-methyl-3-methylideneocta-1,4-diene
CID 173798969

Frequently Asked Questions

What is the IUPAC name of (Z)-5-ethenyl-6-iododec-5-ene?
The IUPAC name of (Z)-5-ethenyl-6-iododec-5-ene (CID 15211599) is (Z)-5-ethenyl-6-iododec-5-ene.
What is the SMILES notation for (Z)-5-ethenyl-6-iododec-5-ene?
The canonical SMILES for (Z)-5-ethenyl-6-iododec-5-ene is C=C/C(CCCC)=C(\I)CCCC.
What is the InChIKey of (Z)-5-ethenyl-6-iododec-5-ene?
The InChIKey is INUQNUZTSAFVIS-VAWYXSNFSA-N. The full InChI is InChI=1S/C12H21I/c1-4-7-9-11(6-3)12(13)10-8-5-2/h6H,3-5,7-10H2,1-2H3/b12-11+.
What are the key properties of (Z)-5-ethenyl-6-iododec-5-ene?
(Z)-5-ethenyl-6-iododec-5-ene has a molecular weight of 292.20 g/mol, XLogP of 5.24, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-ethenyl-6-iododec-5-ene is sourced from PubChem (CID 15211599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).