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820221-58-7

820221-58-7 | Propanedial, monooxime, (1E)-

CAS No: 820221-58-7 Catalog No: AG005E1T MDL No:

Product Description

Catalog Number:
AG005E1T
Chemical Name:
Propanedial, monooxime, (1E)-
CAS Number:
820221-58-7
Molecular Formula:
C3H5NO2
Molecular Weight:
87.0773
IUPAC Name:
3-hydroxyiminopropanal
InChI:
InChI=1S/C3H5NO2/c5-3-1-2-4-6/h2-3,6H,1H2
InChI Key:
ZDVFRLNVNSAHSB-UHFFFAOYSA-N
SMILES:
O/N=C/CC=O

Properties

Complexity:
59.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
87.032g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
87.078g/mol
Monoisotopic Mass:
87.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
-0.4  

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