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51792-36-0 molecular structure
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5-(naphthalen-1-yl)furan-2-carbaldehyde

ChemBase ID: 310710
Molecular Formular: C15H10O2
Molecular Mass: 222.2387
Monoisotopic Mass: 222.06807956
SMILES and InChIs

SMILES:
c1(oc(cc1)C=O)c1c2c(ccc1)cccc2
Canonical SMILES:
O=Cc1ccc(o1)c1cccc2c1cccc2
InChI:
InChI=1S/C15H10O2/c16-10-12-8-9-15(17-12)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H
InChIKey:
CTSWIPKWDHCZMK-UHFFFAOYSA-N

Cite this record

CBID:310710 http://www.chembase.cn/molecule-310710.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
5-(naphthalen-1-yl)furan-2-carbaldehyde
IUPAC Traditional name
5-(naphthalen-1-yl)furan-2-carbaldehyde
Synonyms
5-(1-naphthyl)-2-furaldehyde
CAS Number
51792-36-0
MDL Number
MFCD00582072

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.3026981  LogD (pH = 7.4) 3.3026981 
Log P 3.3026981  Molar Refractivity 66.4968 cm3
Polarizability 27.680271 Å3 Polar Surface Area 30.21 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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