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22078-90-6 molecular structure
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(5-phenylfuran-2-yl)methanol

ChemBase ID: 307056
Molecular Formular: C11H10O2
Molecular Mass: 174.1959
Monoisotopic Mass: 174.06807956
SMILES and InChIs

SMILES:
c1(oc(cc1)CO)c1ccccc1
Canonical SMILES:
OCc1ccc(o1)c1ccccc1
InChI:
InChI=1S/C11H10O2/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-7,12H,8H2
InChIKey:
QPESRPMGQSTWSO-UHFFFAOYSA-N

Cite this record

CBID:307056 http://www.chembase.cn/molecule-307056.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(5-phenylfuran-2-yl)methanol
IUPAC Traditional name
(5-phenylfuran-2-yl)methanol
Synonyms
(5-phenyl-2-furyl)methanol
CAS Number
22078-90-6
MDL Number
MFCD02127353

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.8333691  LogD (pH = 7.4) 1.833369 
Log P 1.8333691  Molar Refractivity 50.2785 cm3
Polarizability 20.628834 Å3 Polar Surface Area 33.37 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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