4-bromo-7,8-dichloro-2-methylquinoline

C10H6BrCl2N — CID 39346159

IUPAC4-bromo-7,8-dichloro-2-methylquinoline
SMILESCc1cc(Br)c2ccc(Cl)c(Cl)c2n1
InChIInChI=1S/C10H6BrCl2N/c1-5-4-7(11)6-2-3-8(12)9(13)10(6)14-5/h2-4H,1H3
InChIKeyQDHVQUUNDXXKDB-UHFFFAOYSA-N
MW290.98 g/mol
LogP4.61
Rot. Bonds

About 4-bromo-7,8-dichloro-2-methylquinoline

4-bromo-7,8-dichloro-2-methylquinoline (PubChem CID 39346159) has the molecular formula C10H6BrCl2N and a molecular weight of 290.98 g/mol. Its IUPAC name is 4-bromo-7,8-dichloro-2-methylquinoline.

Molecular Properties

Compound Name4-bromo-7,8-dichloro-2-methylquinoline
PubChem CID39346159
Molecular FormulaC10H6BrCl2N
Molecular Weight290.98 g/mol
Exact Mass288.91
IUPAC Name4-bromo-7,8-dichloro-2-methylquinoline
SMILESCc1cc(Br)c2ccc(Cl)c(Cl)c2n1
InChIInChI=1S/C10H6BrCl2N/c1-5-4-7(11)6-2-3-8(12)9(13)10(6)14-5/h2-4H,1H3
InChIKeyQDHVQUUNDXXKDB-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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Frequently Asked Questions

What is the IUPAC name of 4-bromo-7,8-dichloro-2-methylquinoline?
The IUPAC name of 4-bromo-7,8-dichloro-2-methylquinoline (CID 39346159) is 4-bromo-7,8-dichloro-2-methylquinoline.
What is the SMILES notation for 4-bromo-7,8-dichloro-2-methylquinoline?
The canonical SMILES for 4-bromo-7,8-dichloro-2-methylquinoline is Cc1cc(Br)c2ccc(Cl)c(Cl)c2n1.
What is the InChIKey of 4-bromo-7,8-dichloro-2-methylquinoline?
The InChIKey is QDHVQUUNDXXKDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrCl2N/c1-5-4-7(11)6-2-3-8(12)9(13)10(6)14-5/h2-4H,1H3.
What are the key properties of 4-bromo-7,8-dichloro-2-methylquinoline?
4-bromo-7,8-dichloro-2-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 4-bromo-7,8-dichloro-2-methylquinoline is sourced from PubChem (CID 39346159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).