6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium

C9H8IRf- — CID 134860933

IUPAC6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium
SMILESIc1[c-]cc2c(c1)CCC2.[Rf]
InChIInChI=1S/C9H8I.Rf/c10-9-5-4-7-2-1-3-8(7)6-9;/h4,6H,1-3H2;/q-1;
InChIKeyPNEMVFHJHBHBOJ-UHFFFAOYSA-N
MW510.07 g/mol
LogP2.58
Rot. Bonds

About 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium

6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium (PubChem CID 134860933) has the molecular formula C9H8IRf- and a molecular weight of 510.07 g/mol. Its IUPAC name is 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium.

Molecular Properties

Compound Name6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium
PubChem CID134860933
Molecular FormulaC9H8IRf-
Molecular Weight510.07 g/mol
Exact Mass510.09
IUPAC Name6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium
SMILESIc1[c-]cc2c(c1)CCC2.[Rf]
InChIInChI=1S/C9H8I.Rf/c10-9-5-4-7-2-1-3-8(7)6-9;/h4,6H,1-3H2;/q-1;
InChIKeyPNEMVFHJHBHBOJ-UHFFFAOYSA-N
XLogP2.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500510.07
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-[(E)-2-iodoethenyl]cyclohexene
CID 10879043
2,4-dihydro-1H-indene
CID 54303970
4-Methylidene-1,2-dihydroindene
CID 134995238
1-Iodoprop-2-enylidenecyclohexane
CID 20765033
1-[(Z)-2-iodoethenyl]cyclohexene
CID 15311442
1-Ethenylcyclohexene;yttrium
CID 135030596
5,6-dihydro-4H-indene
CID 13817834
1-[Cyclopenta-1,3-dien-1-yl(iodo)methyl]cyclopenta-1,3-diene
CID 19868778
2,4,5,6-tetrahydro-1H-indene
CID 53442732
(3E)-1-[(E)-2-iodoethenyl]-3-prop-2-enylidenecyclopentene
CID 58220070
(3E)-1-[(E)-2-iodoethenyl]-3-prop-2-enylidenecyclohexene
CID 58220077
7lambda2-Polonabicyclo[4.3.0]nona-1(6),8-diene
CID 58612451

Frequently Asked Questions

What is the IUPAC name of 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium?
The IUPAC name of 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium (CID 134860933) is 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium.
What is the SMILES notation for 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium?
The canonical SMILES for 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium is Ic1[c-]cc2c(c1)CCC2.[Rf].
What is the InChIKey of 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium?
The InChIKey is PNEMVFHJHBHBOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8I.Rf/c10-9-5-4-7-2-1-3-8(7)6-9;/h4,6H,1-3H2;/q-1;.
What are the key properties of 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium?
6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium has a molecular weight of 510.07 g/mol, XLogP of 2.58, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-iodo-1,2,3,5-tetrahydroinden-5-ide;rutherfordium is sourced from PubChem (CID 134860933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).