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5331-93-1

5331-93-1 | 3,5-dichloro-2-hydroxybenzaldehyde oxime

CAS No: 5331-93-1 Catalog No: AG01CU6T MDL No:MFCD00119095

Product Description

Catalog Number:
AG01CU6T
Chemical Name:
3,5-dichloro-2-hydroxybenzaldehyde oxime
CAS Number:
5331-93-1
Molecular Formula:
C7H5Cl2NO2
Molecular Weight:
206.0261
MDL Number:
MFCD00119095
IUPAC Name:
2,4-dichloro-6-[(E)-hydroxyiminomethyl]phenol
InChI:
InChI=1S/C7H5Cl2NO2/c8-5-1-4(3-10-12)7(11)6(9)2-5/h1-3,11-12H/b10-3+
InChI Key:
SHGLQTKOGKFLAS-XCVCLJGOSA-N
SMILES:
O/N=C/c1cc(Cl)cc(c1O)Cl
NSC Number:
3936

Properties

Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
204.97g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.022g/mol
Monoisotopic Mass:
204.97g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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