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57568-60-2 | 3-(Furan-2-yl)-2-phenylacrylaldehyde
CAS No: 57568-60-2 Catalog No: AG003I0R MDL No:MFCD00036566
Product Description
Catalog Number:
AG003I0R
Chemical Name:
3-(Furan-2-yl)-2-phenylacrylaldehyde
CAS Number:
57568-60-2
Molecular Formula:
C13H10O2
Molecular Weight:
198.2173
MDL Number:
MFCD00036566
IUPAC Name:
(E)-3-(furan-2-yl)-2-phenylprop-2-enal
InChI:
InChI=1S/C13H10O2/c14-10-12(9-13-7-4-8-15-13)11-5-2-1-3-6-11/h1-10H/b12-9-
InChI Key:
JPESOGFYFXAURP-XFXZXTDPSA-N
SMILES:
O=C/C(=C/c1ccco1)/c1ccccc1
UNII:
CHD146V2O2
FEMA Number:
3586
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
198.068g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.221g/mol
Monoisotopic Mass:
198.068g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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