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90298-73-0

90298-73-0 | Propanedioic acid, (1,3-benzodioxol-5-ylhydrazono)-, diethyl ester

CAS No: 90298-73-0 Catalog No: AG006G0H MDL No:

Product Description

Catalog Number:
AG006G0H
Chemical Name:
Propanedioic acid, (1,3-benzodioxol-5-ylhydrazono)-, diethyl ester
CAS Number:
90298-73-0
Molecular Formula:
C14H16N2O6
Molecular Weight:
308.2866
IUPAC Name:
diethyl 2-(1,3-benzodioxol-5-ylhydrazinylidene)propanedioate
InChI:
InChI=1S/C14H16N2O6/c1-3-19-13(17)12(14(18)20-4-2)16-15-9-5-6-10-11(7-9)22-8-21-10/h5-7,15H,3-4,8H2,1-2H3
InChI Key:
QZKDZOMMCXLPQK-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=NNc1ccc2c(c1)OCO2)C(=O)OCC

Properties

Complexity:
419  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.101g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
308.29g/mol
Monoisotopic Mass:
308.101g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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