[(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium

C17H17ClI+ — CID 10790533

IUPAC[(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium
SMILESCl/C(=C\[I+]c1ccccc1)CCCc1ccccc1
InChIInChI=1S/C17H17ClI/c18-16(14-19-17-12-5-2-6-13-17)11-7-10-15-8-3-1-4-9-15/h1-6,8-9,12-14H,7,10-11H2/q+1/b16-14-
InChIKeyXDZFPQJBIOBWIP-PEZBUJJGSA-N
MW383.68 g/mol
LogP2.05
Rot. Bonds6

About [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium

[(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium (PubChem CID 10790533) has the molecular formula C17H17ClI+ and a molecular weight of 383.68 g/mol. Its IUPAC name is [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium.

Molecular Properties

Compound Name[(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium
PubChem CID10790533
Molecular FormulaC17H17ClI+
Molecular Weight383.68 g/mol
Exact Mass383.01
IUPAC Name[(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium
SMILESCl/C(=C\[I+]c1ccccc1)CCCc1ccccc1
InChIInChI=1S/C17H17ClI/c18-16(14-19-17-12-5-2-6-13-17)11-7-10-15-8-3-1-4-9-15/h1-6,8-9,12-14H,7,10-11H2/q+1/b16-14-
InChIKeyXDZFPQJBIOBWIP-PEZBUJJGSA-N
XLogP2.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.68
LogP ≤ 52.05
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

(Z)-3-chloro-7-phenylhept-2-en-1-ol
CID 11138792
4-phenylbutanoyl chloride
CID 11789865
1,4-bis(3-phenylpropyl)benzene
CID 59467322
4-phenylbutylbenzene
CID 141301927
N-methyl-4-[4-(4-phenylbutyl)phenyl]butanamide
CID 58974296
[(Z)-2-chloro-3,3-dimethylbut-1-enyl]-phenyliodanium
CID 10763951
methane;4-phenylbutylbenzene
CID 173386802
hafnium;4-phenylbutylbenzene
CID 175889972
CID 159131095
CID 159131095
5-phenylpentan-2-one
CID 16701
N-[4-(4-oxopentyl)phenyl]-4-phenylbutanamide
CID 21335633
N-(4-butylphenyl)-4-phenylbutanamide
CID 7313944

Frequently Asked Questions

What is the IUPAC name of [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium?
The IUPAC name of [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium (CID 10790533) is [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium.
What is the SMILES notation for [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium?
The canonical SMILES for [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium is Cl/C(=C\[I+]c1ccccc1)CCCc1ccccc1.
What is the InChIKey of [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium?
The InChIKey is XDZFPQJBIOBWIP-PEZBUJJGSA-N. The full InChI is InChI=1S/C17H17ClI/c18-16(14-19-17-12-5-2-6-13-17)11-7-10-15-8-3-1-4-9-15/h1-6,8-9,12-14H,7,10-11H2/q+1/b16-14-.
What are the key properties of [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium?
[(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium has a molecular weight of 383.68 g/mol, XLogP of 2.05, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-chloro-5-phenylpent-1-enyl]-phenyliodanium is sourced from PubChem (CID 10790533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).