5-bromo-3,4-dichloro-8-methylquinoline

C10H6BrCl2N — CID 114759791

IUPAC5-bromo-3,4-dichloro-8-methylquinoline
SMILESCc1ccc(Br)c2c(Cl)c(Cl)cnc12
InChIInChI=1S/C10H6BrCl2N/c1-5-2-3-6(11)8-9(13)7(12)4-14-10(5)8/h2-4H,1H3
InChIKeyCTEHKXXGUFLGSC-UHFFFAOYSA-N
MW290.98 g/mol
LogP4.61
Rot. Bonds

About 5-bromo-3,4-dichloro-8-methylquinoline

5-bromo-3,4-dichloro-8-methylquinoline (PubChem CID 114759791) has the molecular formula C10H6BrCl2N and a molecular weight of 290.98 g/mol. Its IUPAC name is 5-bromo-3,4-dichloro-8-methylquinoline.

Molecular Properties

Compound Name5-bromo-3,4-dichloro-8-methylquinoline
PubChem CID114759791
Molecular FormulaC10H6BrCl2N
Molecular Weight290.98 g/mol
Exact Mass288.91
IUPAC Name5-bromo-3,4-dichloro-8-methylquinoline
SMILESCc1ccc(Br)c2c(Cl)c(Cl)cnc12
InChIInChI=1S/C10H6BrCl2N/c1-5-2-3-6(11)8-9(13)7(12)4-14-10(5)8/h2-4H,1H3
InChIKeyCTEHKXXGUFLGSC-UHFFFAOYSA-N
XLogP4.61
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.98
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-bromo-4-chloro-3-iodo-8-methylquinoline
CID 102614183
5-bromo-4-chloro-8-methylquinazoline
CID 104782240
4,6-dibromo-3,5-dichloro-8-methylquinoline
CID 164661316
4,6-dibromo-5-chloro-8-methylquinoline
CID 164661313
4-bromo-3-chloro-8-methyl-1,5-naphthyridine
CID 103416479
3,5-dibromo-4-chloro-8-methoxyquinoline
CID 114759895
4-chloro-5-fluoro-3,8-dimethylquinoline
CID 171373227
4-bromo-3-chloro-8-methoxy-5-methylquinoline
CID 114763949
8-bromo-4-chloro-3-methyl-5-(trifluoromethyl)quinoline
CID 171373219
5,8-dibromo-4-chloro-3-nitroquinoline
CID 102614186
5-bromo-8-methylquinoline-4-carboxylic acid
CID 165460211
8-bromo-4-chloro-2-ethyl-5-methylquinoline
CID 82766813

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3,4-dichloro-8-methylquinoline?
The IUPAC name of 5-bromo-3,4-dichloro-8-methylquinoline (CID 114759791) is 5-bromo-3,4-dichloro-8-methylquinoline.
What is the SMILES notation for 5-bromo-3,4-dichloro-8-methylquinoline?
The canonical SMILES for 5-bromo-3,4-dichloro-8-methylquinoline is Cc1ccc(Br)c2c(Cl)c(Cl)cnc12.
What is the InChIKey of 5-bromo-3,4-dichloro-8-methylquinoline?
The InChIKey is CTEHKXXGUFLGSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrCl2N/c1-5-2-3-6(11)8-9(13)7(12)4-14-10(5)8/h2-4H,1H3.
What are the key properties of 5-bromo-3,4-dichloro-8-methylquinoline?
5-bromo-3,4-dichloro-8-methylquinoline has a molecular weight of 290.98 g/mol, XLogP of 4.61, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3,4-dichloro-8-methylquinoline is sourced from PubChem (CID 114759791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).