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20399-90-0 | Acetaldehyde, 2-(2-phenyl-4H-1-benzopyran-4-ylidene)-
CAS No: 20399-90-0 Catalog No: AG00298A MDL No:
Product Description
Catalog Number:
AG00298A
Chemical Name:
Acetaldehyde, 2-(2-phenyl-4H-1-benzopyran-4-ylidene)-
CAS Number:
20399-90-0
Molecular Formula:
C17H12O2
Molecular Weight:
248.2760
IUPAC Name:
2-(2-phenylchromen-4-ylidene)acetaldehyde
InChI:
InChI=1S/C17H12O2/c18-11-10-14-12-17(13-6-2-1-3-7-13)19-16-9-5-4-8-15(14)16/h1-12H
InChI Key:
ZBSQNOLTGSHPRX-UHFFFAOYSA-N
SMILES:
O=CC=C1C=C(Oc2c1cccc2)c1ccccc1
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.084g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.281g/mol
Monoisotopic Mass:
248.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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