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197856-09-0 | 4-Selenazolecarboxylic acid, 5-[(2,6-dimethylphenyl)amino]-, ethyl ester
CAS No: 197856-09-0 Catalog No: AG002B4L MDL No:
Product Description
Catalog Number:
AG002B4L
Chemical Name:
4-Selenazolecarboxylic acid, 5-[(2,6-dimethylphenyl)amino]-, ethyl ester
CAS Number:
197856-09-0
Molecular Formula:
C14H16N2O2Se
Molecular Weight:
323.2490
IUPAC Name:
ethyl 5-(2,6-dimethylanilino)-1,3-selenazole-4-carboxylate
InChI:
InChI=1S/C14H16N2O2Se/c1-4-18-14(17)12-13(19-8-15-12)16-11-9(2)6-5-7-10(11)3/h5-8,16H,4H2,1-3H3
InChI Key:
NXXXFZCBKNOFEE-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc[se]c1Nc1c(C)cccc1C
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.038g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
323.265g/mol
Monoisotopic Mass:
324.038g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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