butyl-chloro-triphenyl-λ5-arsane

C22H24AsCl — CID 140527829

IUPACbutyl-chloro-triphenyl-λ5-arsane
SMILESCCCC[As](Cl)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H24AsCl/c1-2-3-19-23(24,20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,2-3,19H2,1H3
InChIKeyZJWWYJBFLNPCDR-UHFFFAOYSA-N
MW398.81 g/mol
LogP4.65
Rot. Bonds6

About butyl-chloro-triphenyl-λ5-arsane

butyl-chloro-triphenyl-λ5-arsane (PubChem CID 140527829) has the molecular formula C22H24AsCl and a molecular weight of 398.81 g/mol. Its IUPAC name is butyl-chloro-triphenyl-λ5-arsane.

Molecular Properties

Compound Namebutyl-chloro-triphenyl-λ5-arsane
PubChem CID140527829
Molecular FormulaC22H24AsCl
Molecular Weight398.81 g/mol
Exact Mass398.08
IUPAC Namebutyl-chloro-triphenyl-λ5-arsane
SMILESCCCC[As](Cl)(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H24AsCl/c1-2-3-19-23(24,20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,2-3,19H2,1H3
InChIKeyZJWWYJBFLNPCDR-UHFFFAOYSA-N
XLogP4.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.81
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 173308514
octylbenzene
CID 16607
butylbenzene;propylbenzene
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octacosylbenzene
CID 14228596
pentadecane;pentadecylbenzene
CID 174970881
octaoctacontylbenzene
CID 165359374
pentanonacontylbenzene
CID 165359347
butyl(triphenyl)plumbane
CID 3421229
dichlorophosphane;octylbenzene
CID 173449895
1,1-dichloroethane;pentylbenzene
CID 158559289
CID 67791041
CID 67791041
hexylbenzene;hydrogen peroxide
CID 90001206

Frequently Asked Questions

What is the IUPAC name of butyl-chloro-triphenyl-λ5-arsane?
The IUPAC name of butyl-chloro-triphenyl-λ5-arsane (CID 140527829) is butyl-chloro-triphenyl-λ5-arsane.
What is the SMILES notation for butyl-chloro-triphenyl-λ5-arsane?
The canonical SMILES for butyl-chloro-triphenyl-λ5-arsane is CCCC[As](Cl)(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of butyl-chloro-triphenyl-λ5-arsane?
The InChIKey is ZJWWYJBFLNPCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24AsCl/c1-2-3-19-23(24,20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,2-3,19H2,1H3.
What are the key properties of butyl-chloro-triphenyl-λ5-arsane?
butyl-chloro-triphenyl-λ5-arsane has a molecular weight of 398.81 g/mol, XLogP of 4.65, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-chloro-triphenyl-λ5-arsane is sourced from PubChem (CID 140527829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).