COC1=CC2=NC=CC(=C2C=C1)Cl
CAS: 68500-37-8
Nom: 4-chloro-7-methoxyquinoline
SMILES: COC1=CC2=NC=CC(=C2C=C1)Cl

Molecular Processing

Molecular formula
C10H8ClNO
Molecular weight
193.63
Exact mass
193.0294
XLogP
2.9
TPSA
22.12
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
53.31

Supplementary Information

InChIKey: UKTYNFPTZDSBLR-UHFFFAOYSA-N
Synonymes
4-chloro-7-methoxyquinoline68500-37-8DTXSID90442394RefChem:291929DTXCID30393215676-017-84-Chloro-7-methoxy-quinolineMFCD06659036QUINOLINE, 4-CHLORO-7-METHOXY-7-Methoxy-4-chloroquinolineSCHEMBL201122CHEMBL4468786SCHEMBL29362202(4-chloroquinolin-7-yl)methyl etherSBB079287AKOS002683687AC-3133CS-W003314FS-2270PB123794-Chloro-7-methoxyquinoline, AldrichCPRSY003966DB-006771EN300-88493F040473Z414834566
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→