8-(dichloromethyl)quinoline

C10H7Cl2N — CID 19989328

IUPAC8-(dichloromethyl)quinoline
SMILESClC(Cl)c1cccc2cccnc12
InChIInChI=1S/C10H7Cl2N/c11-10(12)8-5-1-3-7-4-2-6-13-9(7)8/h1-6,10H
InChIKeySANKNASVOFWIOU-UHFFFAOYSA-N
MW212.08 g/mol
LogP3.71
Rot. Bonds1

About 8-(dichloromethyl)quinoline

8-(dichloromethyl)quinoline (PubChem CID 19989328) has the molecular formula C10H7Cl2N and a molecular weight of 212.08 g/mol. Its IUPAC name is 8-(dichloromethyl)quinoline.

Molecular Properties

Compound Name8-(dichloromethyl)quinoline
PubChem CID19989328
Molecular FormulaC10H7Cl2N
Molecular Weight212.08 g/mol
Exact Mass211.00
IUPAC Name8-(dichloromethyl)quinoline
SMILESClC(Cl)c1cccc2cccnc12
InChIInChI=1S/C10H7Cl2N/c11-10(12)8-5-1-3-7-4-2-6-13-9(7)8/h1-6,10H
InChIKeySANKNASVOFWIOU-UHFFFAOYSA-N
XLogP3.71
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.08
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-2-quinolin-8-ylacetonitrile
CID 63968739
1-quinolin-8-ylethane-1,2-diamine
CID 63968089
dicalcium;chloroform;tetrakis(erbium(3+));hexadecakis(quinolin-8-olate)
CID 139170865
magnesium;chloroform;bis(dysprosium(3+));octakis(quinolin-8-olate)
CID 139170863
2-amino-1-quinolin-8-ylpropan-1-ol
CID 63969290
(3-chloro-2-methylphenyl)-quinolin-8-ylmethanamine
CID 107102903
(2-methylpyrimidin-4-yl)-quinolin-8-ylmethanol
CID 115527954
(2-chloro-3-methylphenyl)-quinolin-8-ylmethanol
CID 115826971
3-methyl-2-quinolin-8-ylbutan-1-amine
CID 83886423
1-quinolin-8-ylbutan-1-amine
CID 79016206
N-propan-2-yl-3-quinolin-8-ylbutan-2-amine
CID 81224234
1,10-phenanthroline;samarium
CID 174616745

Frequently Asked Questions

What is the IUPAC name of 8-(dichloromethyl)quinoline?
The IUPAC name of 8-(dichloromethyl)quinoline (CID 19989328) is 8-(dichloromethyl)quinoline.
What is the SMILES notation for 8-(dichloromethyl)quinoline?
The canonical SMILES for 8-(dichloromethyl)quinoline is ClC(Cl)c1cccc2cccnc12.
What is the InChIKey of 8-(dichloromethyl)quinoline?
The InChIKey is SANKNASVOFWIOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Cl2N/c11-10(12)8-5-1-3-7-4-2-6-13-9(7)8/h1-6,10H.
What are the key properties of 8-(dichloromethyl)quinoline?
8-(dichloromethyl)quinoline has a molecular weight of 212.08 g/mol, XLogP of 3.71, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(dichloromethyl)quinoline is sourced from PubChem (CID 19989328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).