Home > Compound List > Compound details
1185768-18-6 molecular structure
click picture or here to close

7-fluoroquinoline-6-carbaldehyde

ChemBase ID: 287760
Molecular Formular: C10H6FNO
Molecular Mass: 175.1591432
Monoisotopic Mass: 175.04334204
SMILES and InChIs

SMILES:
O=Cc1c(F)cc2ncccc2c1
Canonical SMILES:
O=Cc1cc2cccnc2cc1F
InChI:
InChI=1S/C10H6FNO/c11-9-5-10-7(2-1-3-12-10)4-8(9)6-13/h1-6H
InChIKey:
MXHXHJCXWSYDQO-UHFFFAOYSA-N

Cite this record

CBID:287760 http://www.chembase.cn/molecule-287760.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
7-fluoroquinoline-6-carbaldehyde
IUPAC Traditional name
7-fluoroquinoline-6-carbaldehyde
Synonyms
7-Fluoroquinoline-6-carbaldehyde
CAS Number
1185768-18-6
MDL Number
MFCD16659698
PubChem SID
180673291
PubChem CID
52982909

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 52982909 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.9798841  LogD (pH = 7.4) 1.9860258 
Log P 1.9861047  Molar Refractivity 46.7797 cm3
Polarizability 18.483671 Å3 Polar Surface Area 29.96 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
95+% expand Show data source
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle