1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene

C9H9Cl5OTe — CID 13296254

IUPAC1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene
SMILESClc1ccc(OCC(Cl)C[Te](Cl)(Cl)Cl)cc1
InChIInChI=1S/C9H9Cl5OTe/c10-7-1-3-9(4-2-7)15-5-8(11)6-16(12,13)14/h1-4,8H,5-6H2
InChIKeyNAKQAQQNVDRTEK-UHFFFAOYSA-N
MW438.04 g/mol
LogP4.98
Rot. Bonds5

About 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene

1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene (PubChem CID 13296254) has the molecular formula C9H9Cl5OTe and a molecular weight of 438.04 g/mol. Its IUPAC name is 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene.

Molecular Properties

Compound Name1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene
PubChem CID13296254
Molecular FormulaC9H9Cl5OTe
Molecular Weight438.04 g/mol
Exact Mass437.82
IUPAC Name1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene
SMILESClc1ccc(OCC(Cl)C[Te](Cl)(Cl)Cl)cc1
InChIInChI=1S/C9H9Cl5OTe/c10-7-1-3-9(4-2-7)15-5-8(11)6-16(12,13)14/h1-4,8H,5-6H2
InChIKeyNAKQAQQNVDRTEK-UHFFFAOYSA-N
XLogP4.98
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.04
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-4-(2,2-dichloroethoxy)benzene
CID 143327001
(2S)-1-amino-3-(4-chlorophenoxy)propan-2-ol
CID 2049238
2-amino-3-(4-chlorophenoxy)propanenitrile
CID 55270020
(2S)-3-(4-chlorophenoxy)-2-methylpropanoic acid
CID 10353214
1-(4-chlorophenoxy)-5-methylhex-5-en-2-ol
CID 105127338
3-(4-chlorophenoxy)-1-N,1-N-dimethylpropane-1,2-diamine
CID 116820989
3-amino-4-(4-chlorophenoxy)butanenitrile
CID 82126783
1-(4-chlorophenoxy)-3-methoxy-N-methylpropan-2-amine
CID 105165684
methyl (2S)-2-amino-3-(4-chlorophenoxy)propanoate
CID 99737689
1-(4-chlorophenyl)-2-(4-methylphenoxy)ethanamine
CID 82027704
methyl 3-(4-chlorophenoxy)-2-methylpropanoate
CID 43537622
[3-(4-chlorophenoxy)-2-hydroxypropyl]-propan-2-ylazanium
CID 4751881

Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene?
The IUPAC name of 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene (CID 13296254) is 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene.
What is the SMILES notation for 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene?
The canonical SMILES for 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene is Clc1ccc(OCC(Cl)C[Te](Cl)(Cl)Cl)cc1.
What is the InChIKey of 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene?
The InChIKey is NAKQAQQNVDRTEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9Cl5OTe/c10-7-1-3-9(4-2-7)15-5-8(11)6-16(12,13)14/h1-4,8H,5-6H2.
What are the key properties of 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene?
1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene has a molecular weight of 438.04 g/mol, XLogP of 4.98, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-[2-chloro-3-(trichloro-lambda4-tellanyl)propoxy]benzene is sourced from PubChem (CID 13296254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).