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67002-21-5 | 1,3,5-Benzenetricarboxaldehyde, trioxime
CAS No: 67002-21-5 Catalog No: AG005RGR MDL No:
Product Description
Catalog Number:
AG005RGR
Chemical Name:
1,3,5-Benzenetricarboxaldehyde, trioxime
CAS Number:
67002-21-5
Molecular Formula:
C9H9N3O3
Molecular Weight:
207.1861
IUPAC Name:
N-[[3,5-bis(hydroxyiminomethyl)phenyl]methylidene]hydroxylamine
InChI:
InChI=1S/C9H9N3O3/c13-10-4-7-1-8(5-11-14)3-9(2-7)6-12-15/h1-6,13-15H
InChI Key:
FVLSTTKRJNPHIW-UHFFFAOYSA-N
SMILES:
ON=Cc1cc(C=NO)cc(c1)C=NO
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.064g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
207.189g/mol
Monoisotopic Mass:
207.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
XLogP3:
1.1
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