7-Chloro-4-methyl-8-nitroisoquinoline

HCID 20523218
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Basic information

Standard SMILES
Cc1cncc2c([N+](=O)[O-])c(Cl)ccc12
InChIKey
YXXTXYCUBUMLHB-UHFFFAOYSA-N
Molecular formula
C10H7ClN2O2
Average molar mass
222.63 g/mol

Names & identifiers

Preferred name
7-Chloro-4-methyl-8-nitroisoquinoline
IUPAC
7-chloro-4-methyl-8-nitroisoquinoline

Names & synonyms

SCHEMBL10921245YXXTXYCUBUMLHB-UHFFFAOYSA-N7-chloro-4-methyl-8-nitroisoquinoline

Database identifiers

PubChem CID
20523218

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
58.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
15

Related reactions

3 records
New reaction record

Compound notes

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