CID 11233835

C9H8I — CID 11233835

IUPAC—
SMILESI/C=C/C=C/[C]1[CH][CH][CH][CH]1
InChIInChI=1S/C9H8I/c10-8-4-3-7-9-5-1-2-6-9/h1-8H/b7-3+,8-4+
InChIKeySUHHUQUGUWDYIX-FCXRPNKRSA-N
MW243.07 g/mol
LogP2.90
Rot. Bonds2

About CID 11233835

CID 11233835 (PubChem CID 11233835) has the molecular formula C9H8I and a molecular weight of 243.07 g/mol.

Molecular Properties

Compound NameCID 11233835
PubChem CID11233835
Molecular FormulaC9H8I
Molecular Weight243.07 g/mol
Exact Mass242.97
IUPAC Name—
SMILESI/C=C/C=C/[C]1[CH][CH][CH][CH]1
InChIInChI=1S/C9H8I/c10-8-4-3-7-9-5-1-2-6-9/h1-8H/b7-3+,8-4+
InChIKeySUHHUQUGUWDYIX-FCXRPNKRSA-N
XLogP2.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.07
LogP ≤ 52.90
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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Frequently Asked Questions

What is the IUPAC name of CID 11233835?
The IUPAC name of CID 11233835 (CID 11233835) is not available.
What is the SMILES notation for CID 11233835?
The canonical SMILES for CID 11233835 is I/C=C/C=C/[C]1[CH][CH][CH][CH]1.
What is the InChIKey of CID 11233835?
The InChIKey is SUHHUQUGUWDYIX-FCXRPNKRSA-N. The full InChI is InChI=1S/C9H8I/c10-8-4-3-7-9-5-1-2-6-9/h1-8H/b7-3+,8-4+.
What are the key properties of CID 11233835?
CID 11233835 has a molecular weight of 243.07 g/mol, XLogP of 2.90, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11233835 is sourced from PubChem (CID 11233835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).