N-(diaminomethylidene)-2-(2,6-dichloro-3,4,5-trideuteriophenyl)acetamide


Chemical Name: N-(diaminomethylidene)-2-(2,6-dichloro-3,4,5-trideuteriophenyl)acetamide
CAS Number: 29110-47-2
Product Number: AG002XCA(AGN-PC-04XZ20)
Synonyms:
MDL No: MFCD00865944
Molecular Formula: C9H9Cl2N3O
Molecular Weight: 246.0933

Identification/Properties


Computed Properties
Molecular Weight:
246.091g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
245.012g/mol
Monoisotopic Mass:
245.012g/mol
Topological Polar Surface Area:
81.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
256
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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