6,8,9-Trichloro-2,3,3a,4,5,9b-hexahydro-furo[3,2-c]quinoline-4-carboxylic acid

HCID 9966966
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(O)C1Nc2c(Cl)cc(Cl)c(Cl)c2C2OCCC12
InChIKey
KZHPYJCXVRMSPV-UHFFFAOYSA-N
Molecular formula
C12H10Cl3NO3
Average molar mass
322.6 g/mol

Names & identifiers

Preferred name
6,8,9-Trichloro-2,3,3a,4,5,9b-hexahydro-furo[3,2-c]quinoline-4-carboxylic acid
IUPAC
6,8,9-trichloro-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline-4-carboxylic acid

Names & synonyms

SCHEMBL6212278KZHPYJCXVRMSPV-UHFFFAOYSA-N6,8,9-trichloro-2,3,3a,4,5,9b-hexahydro-furo[3,2-c]quinoline-4-carboxylic acid

Database identifiers

PubChem CID
9966966

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
58.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
19

Related reactions

2 records
New reaction record

Linked notes

Loading…