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28752-82-1 | Benzaldehyde, 2-(2-propen-1-yloxy)-
CAS No: 28752-82-1 Catalog No: AG002WDA MDL No:MFCD00014130
Product Description
Catalog Number:
AG002WDA
Chemical Name:
Benzaldehyde, 2-(2-propen-1-yloxy)-
CAS Number:
28752-82-1
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
MDL Number:
MFCD00014130
IUPAC Name:
2-prop-2-enoxybenzaldehyde
InChI:
InChI=1S/C10H10O2/c1-2-7-12-10-6-4-3-5-9(10)8-11/h2-6,8H,1,7H2
InChI Key:
BXCJDECTRRMSCV-UHFFFAOYSA-N
SMILES:
C=CCOc1ccccc1C=O
EC Number:
249-198-2
NSC Number:
406724
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| A simple radical addition-elimination route to geometrically pure (E)-alkene and chromanone derivatives via beta-nitrostyrene. | The Journal of organic chemistry 20040528 |
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