Product Name: N-3-Dibenzothienylacetamide 5-oxide (CAS NO.63020-21-3)
Molecular Formula: C14H11NO2S
Molecular Weight: 257.32g/mol
Mol File: 63020-21-3.mol
XLogP3-AA: 2.3
H-Bond Donor: 1
H-Bond Acceptor: 2
Structure Descriptors of N-3-Dibenzothienylacetamide 5-oxide (CAS NO.63020-21-3):
IUPAC Name: N-(5-oxodibenzothiophen-3-yl)acetamide
Canonical SMILES: CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3S2=O
InChI: InChI=1S/C14H11NO2S/c1-9(16)15-10-6-7-12-11-4-2-3-5-13(11)18(17)14(12)8-10/h2-8H,1H3,(H,15,16)
InChIKey: YWILOBPANZQBKI-UHFFFAOYSA-N
Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits very toxic fumes of SOx and NOx.
N-3-Dibenzothienylacetamide 5-oxide ,its CAS NO. is 63020-21-3,the synonyms is 3-Acetamidodibenzthiophene oxide ; 3-Acetylaminodibenzothiophene-5-oxide ; 4-18-00-07205 (Beilstein Handbook Reference) ; BRN 0016835 ; Acetamide, N-3-dibenzothienyl-, 5-oxide .
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