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70-97-3 | oxo(4-phenoxyphenyl)acetaldehyde
CAS No: 70-97-3 Catalog No: AG005PE7 MDL No:
Product Description
Catalog Number:
AG005PE7
Chemical Name:
oxo(4-phenoxyphenyl)acetaldehyde
CAS Number:
70-97-3
Molecular Formula:
C14H10O3
Molecular Weight:
226.2274
IUPAC Name:
2-oxo-2-(4-phenoxyphenyl)acetaldehyde
InChI:
InChI=1S/C14H10O3/c15-10-14(16)11-6-8-13(9-7-11)17-12-4-2-1-3-5-12/h1-10H
InChI Key:
RCMGUDDPKUIMTI-UHFFFAOYSA-N
SMILES:
O=CC(=O)c1ccc(cc1)Oc1ccccc1
UNII:
4I5SNZ6LNJ
NSC Number:
89023
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.063g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.231g/mol
Monoisotopic Mass:
226.063g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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