1,1-diiodonon-1-ene

C9H16I2 — CID 141002826

IUPAC1,1-diiodonon-1-ene
SMILESCCCCCCCC=C(I)I
InChIInChI=1S/C9H16I2/c1-2-3-4-5-6-7-8-9(10)11/h8H,2-7H2,1H3
InChIKeyAWNHBBOTIRHICC-UHFFFAOYSA-N
MW378.04 g/mol
LogP5.06
Rot. Bonds6

About 1,1-diiodonon-1-ene

1,1-diiodonon-1-ene (PubChem CID 141002826) has the molecular formula C9H16I2 and a molecular weight of 378.04 g/mol. Its IUPAC name is 1,1-diiodonon-1-ene.

Molecular Properties

Compound Name1,1-diiodonon-1-ene
PubChem CID141002826
Molecular FormulaC9H16I2
Molecular Weight378.04 g/mol
Exact Mass377.93
IUPAC Name1,1-diiodonon-1-ene
SMILESCCCCCCCC=C(I)I
InChIInChI=1S/C9H16I2/c1-2-3-4-5-6-7-8-9(10)11/h8H,2-7H2,1H3
InChIKeyAWNHBBOTIRHICC-UHFFFAOYSA-N
XLogP5.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.04
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(E)-2-iodonon-2-ene
CID 10444893
1-ethoxy-1-iodooct-1-ene
CID 173444253
undec-1-ene-1,1-diol
CID 87556705
2-methylhenicos-2-ene;dihydrobromide
CID 175068359
1,1-dibromotridec-1-ene
CID 14681915
tricos-1-ene-1,1-diamine
CID 141373485
(9E,11E,12E,13E)-11,12-di(nonylidene)docosa-9,13-diene
CID 140635573
2-iodooct-2-enal
CID 74960497
5-iodotridec-5-en-4-ol
CID 141095237
(Z)-3-methylheptadec-3-ene
CID 159647191
3-methylicos-3-ene
CID 91445266
1-sulfanyltetradec-1-en-1-ol
CID 175360116

Frequently Asked Questions

What is the IUPAC name of 1,1-diiodonon-1-ene?
The IUPAC name of 1,1-diiodonon-1-ene (CID 141002826) is 1,1-diiodonon-1-ene.
What is the SMILES notation for 1,1-diiodonon-1-ene?
The canonical SMILES for 1,1-diiodonon-1-ene is CCCCCCCC=C(I)I.
What is the InChIKey of 1,1-diiodonon-1-ene?
The InChIKey is AWNHBBOTIRHICC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16I2/c1-2-3-4-5-6-7-8-9(10)11/h8H,2-7H2,1H3.
What are the key properties of 1,1-diiodonon-1-ene?
1,1-diiodonon-1-ene has a molecular weight of 378.04 g/mol, XLogP of 5.06, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diiodonon-1-ene is sourced from PubChem (CID 141002826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).