CID 170843671

C6H11Cl2 — CID 170843671

IUPAC—
SMILES[CH2]CCCCC(Cl)Cl
InChIInChI=1S/C6H11Cl2/c1-2-3-4-5-6(7)8/h6H,1-5H2
InChIKeyWOIPZJMHKWVFPA-UHFFFAOYSA-N
MW154.06 g/mol
LogP3.18
Rot. Bonds4

About CID 170843671

CID 170843671 (PubChem CID 170843671) has the molecular formula C6H11Cl2 and a molecular weight of 154.06 g/mol.

Molecular Properties

Compound NameCID 170843671
PubChem CID170843671
Molecular FormulaC6H11Cl2
Molecular Weight154.06 g/mol
Exact Mass153.02
IUPAC Name—
SMILES[CH2]CCCCC(Cl)Cl
InChIInChI=1S/C6H11Cl2/c1-2-3-4-5-6(7)8/h6H,1-5H2
InChIKeyWOIPZJMHKWVFPA-UHFFFAOYSA-N
XLogP3.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.06
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,1,6,6-tetrachlorohexane
CID 87407260
CID 76519424
CID 76519424
1,1-dichloroheptane
CID 13184
2-(5,5-dichloropentyl)propane-1,3-diol
CID 18674567
1,1-dichloro-4-fluorobutane
CID 22321169
1,5,5-trichloropentan-1-amine
CID 57159022
1,1-dichloropentane;gallane
CID 174452216
22,22-dichlorodocosyl(methyl)silane
CID 170842182
1,1-dichloro-6-fluorooctane
CID 88501273
19,19-dichlorononadec-1-yne
CID 88635184
10,10-dichlorodecyl(methyl)silane
CID 57370743
5,5-dichloropentyl acetate
CID 57290861

Frequently Asked Questions

What is the IUPAC name of CID 170843671?
The IUPAC name of CID 170843671 (CID 170843671) is not available.
What is the SMILES notation for CID 170843671?
The canonical SMILES for CID 170843671 is [CH2]CCCCC(Cl)Cl.
What is the InChIKey of CID 170843671?
The InChIKey is WOIPZJMHKWVFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11Cl2/c1-2-3-4-5-6(7)8/h6H,1-5H2.
What are the key properties of CID 170843671?
CID 170843671 has a molecular weight of 154.06 g/mol, XLogP of 3.18, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170843671 is sourced from PubChem (CID 170843671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).