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124286-43-7

124286-43-7 | Propanedioic acid, methyl(2-oxo-2-phenylethyl)-, diethyl ester (9CI)

CAS No: 124286-43-7 Catalog No: AG000LT3 MDL No:

Product Description

Catalog Number:
AG000LT3
Chemical Name:
Propanedioic acid, methyl(2-oxo-2-phenylethyl)-, diethyl ester (9CI)
CAS Number:
124286-43-7
Molecular Formula:
C16H20O5
Molecular Weight:
292.3270
IUPAC Name:
diethyl 2-methyl-2-phenacylpropanedioate
InChI:
InChI=1S/C16H20O5/c1-4-20-14(18)16(3,15(19)21-5-2)11-13(17)12-9-7-6-8-10-12/h6-10H,4-5,11H2,1-3H3
InChI Key:
MOILYRRXFHEJRM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)OCC)(CC(=O)c1ccccc1)C

Properties

Complexity:
364  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.131g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.331g/mol
Monoisotopic Mass:
292.131g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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