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10272-02-3 | Selenocyanic acid, 4-(dimethylamino)phenyl ester
CAS No: 10272-02-3 Catalog No: AG00087V MDL No:
Product Description
Catalog Number:
AG00087V
Chemical Name:
Selenocyanic acid, 4-(dimethylamino)phenyl ester
CAS Number:
10272-02-3
Molecular Formula:
C9H10N2Se
Molecular Weight:
225.1491
IUPAC Name:
[4-(dimethylamino)phenyl] selenocyanate
InChI:
InChI=1S/C9H10N2Se/c1-11(2)8-3-5-9(6-4-8)12-7-10/h3-6H,1-2H3
InChI Key:
FSHJCRFWICDPNE-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)[Se]C#N)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.001g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.164g/mol
Monoisotopic Mass:
226.001g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Selenocyanates and diselenides: a new class of potent antileishmanial agents. | European journal of medicinal chemistry 20110801 |
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