1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene

C9H8ClI — CID 154712209

IUPAC1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene
SMILESC/C=C(\I)c1ccc(Cl)cc1
InChIInChI=1S/C9H8ClI/c1-2-9(11)7-3-5-8(10)6-4-7/h2-6H,1H3/b9-2-
InChIKeyMULDJSKJXUXADM-MBXJOHMKSA-N
MW278.52 g/mol
LogP4.14
Rot. Bonds1

About 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene

1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene (PubChem CID 154712209) has the molecular formula C9H8ClI and a molecular weight of 278.52 g/mol. Its IUPAC name is 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene.

Molecular Properties

Compound Name1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene
PubChem CID154712209
Molecular FormulaC9H8ClI
Molecular Weight278.52 g/mol
Exact Mass277.94
IUPAC Name1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene
SMILESC/C=C(\I)c1ccc(Cl)cc1
InChIInChI=1S/C9H8ClI/c1-2-9(11)7-3-5-8(10)6-4-7/h2-6H,1H3/b9-2-
InChIKeyMULDJSKJXUXADM-MBXJOHMKSA-N
XLogP4.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.52
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-4-(1-fluoroprop-1-enyl)benzene
CID 66592587
1-chloro-4-[(3Z)-penta-1,3-dien-3-yl]benzene
CID 58174508
1-chloro-4-[(E)-1-chloro-2-iodoethenyl]benzene
CID 166064052
4-(4-chlorophenyl)benzoyl iodide
CID 90184448
acetaldehyde;2-bromo-1-(4-chlorophenyl)ethanone
CID 158415531
(1Z,3E)-1-(4-chlorophenyl)penta-1,3-dien-1-ol
CID 142112185
1-chloro-4-[(E)-1,2-dichloro-2-(4-chlorophenyl)ethenyl]benzene
CID 13114440
1-[(Z)-2-bromo-1-fluoroethenyl]-4-chlorobenzene
CID 125477288
1-chloro-4-[1-(4-chlorophenyl)-2-methoxyethenyl]benzene
CID 157400104
1-[(E)-2-bromo-1-chloro-2-iodoethenyl]-4-chlorobenzene
CID 166063999
4-amino-1-(4-chlorophenyl)pentan-1-one
CID 116571618
1-chloro-4-(2,2-diiodoethenyl)benzene
CID 6422982

Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene?
The IUPAC name of 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene (CID 154712209) is 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene.
What is the SMILES notation for 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene?
The canonical SMILES for 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene is C/C=C(\I)c1ccc(Cl)cc1.
What is the InChIKey of 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene?
The InChIKey is MULDJSKJXUXADM-MBXJOHMKSA-N. The full InChI is InChI=1S/C9H8ClI/c1-2-9(11)7-3-5-8(10)6-4-7/h2-6H,1H3/b9-2-.
What are the key properties of 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene?
1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene has a molecular weight of 278.52 g/mol, XLogP of 4.14, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-[(Z)-1-iodoprop-1-enyl]benzene is sourced from PubChem (CID 154712209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).