[(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene

C14H10ClI — CID 12555898

IUPAC[(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene
SMILESCl/C(=C(\I)c1ccccc1)c1ccccc1
InChIInChI=1S/C14H10ClI/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10H/b14-13-
InChIKeyAYGQIZWHXPPPHA-YPKPFQOOSA-N
MW340.59 g/mol
LogP5.19
Rot. Bonds2

About [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene

[(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene (PubChem CID 12555898) has the molecular formula C14H10ClI and a molecular weight of 340.59 g/mol. Its IUPAC name is [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene.

Molecular Properties

Compound Name[(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene
PubChem CID12555898
Molecular FormulaC14H10ClI
Molecular Weight340.59 g/mol
Exact Mass339.95
IUPAC Name[(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene
SMILESCl/C(=C(\I)c1ccccc1)c1ccccc1
InChIInChI=1S/C14H10ClI/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10H/b14-13-
InChIKeyAYGQIZWHXPPPHA-YPKPFQOOSA-N
XLogP5.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.59
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2,2-dibromo-1-chloroethenyl)benzene
CID 154173711
benzene;hypochlorous acid;phenol
CID 174898371
(Z)-3-chloro-2,3-diphenylprop-2-enenitrile
CID 21395317
benzoic acid;benzoyl chloride
CID 87427055
[(1Z,3E)-1-chloro-2-methyl-4-phenylbuta-1,3-dienyl]benzene
CID 11680420
ethyl (E)-3-chloro-2-iodo-3-phenylprop-2-enoate
CID 11544593
1-[(Z)-1-chloro-2-(4-methylphenyl)-2-phenylethenyl]-4-methylbenzene
CID 100919311
(E)-3-chloro-3-iodo-2-phenylprop-2-enenitrile
CID 134893810
azane;hypochlorous acid;phenol
CID 159093398
benzoyl chloride;selane
CID 174449470
(NE,E)-N-[chloro(phenyl)methylidene]benzenecarbohydrazonoyl chloride
CID 6141172
tetrakis(carbonochloridic acid);diphenylmethanone
CID 173240243

Frequently Asked Questions

What is the IUPAC name of [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene?
The IUPAC name of [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene (CID 12555898) is [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene.
What is the SMILES notation for [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene?
The canonical SMILES for [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene is Cl/C(=C(\I)c1ccccc1)c1ccccc1.
What is the InChIKey of [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene?
The InChIKey is AYGQIZWHXPPPHA-YPKPFQOOSA-N. The full InChI is InChI=1S/C14H10ClI/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10H/b14-13-.
What are the key properties of [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene?
[(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene has a molecular weight of 340.59 g/mol, XLogP of 5.19, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-1-chloro-2-iodo-2-phenylethenyl]benzene is sourced from PubChem (CID 12555898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).