B34680
Biphenyl-4-carboxaldehyde
99%
Sinónimos:
4-Phenylbenzaldehyde
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About This Item
Fórmula lineal:
C6H5C6H4CHO
Número de CAS:
Peso molecular:
182.22
Beilstein/REAXYS Number:
606693
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
assay
99%
form
crystals
bp
184 °C/11 mmHg (lit.)
mp
57-59 °C (lit.)
SMILES string
O=Cc1ccc(cc1)-c2ccccc2
InChI
1S/C13H10O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-10H
InChI key
ISDBWOPVZKNQDW-UHFFFAOYSA-N
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signalword
Warning
hcodes
pcodes
Hazard Classifications
Acute Tox. 4 Oral
Storage Class
11 - Combustible Solids
wgk_germany
WGK 1
flash_point_f
352.0 - 381.9 °F
flash_point_c
177.8 - 194.4 °C
ppe
dust mask type N95 (US), Eyeshields, Gloves
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The present work emphasizes the value of periodic density functional theory (DFT) calculations in the assessment of the vibrational spectra of molecular crystals. Periodic calculations provide a nearly one-to-one match between the calculated and observed bands in the inelastic neutron
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The new Schiff bases bearing anthracene unit were synthesized from 2-aminoanthracene and various aldehydes such as: benzaldehyde, 4-(diphenylamino)benzaldehyde, 9-phenanthrenecarboxaldehyde, 9-anthracenecarboxaldehyde, and biphenyl-4-carboxaldehyde, 2-naphthaldehyde. Resulted azomethines were characterized by IR, NMR (
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