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3-[1-methyl-2-(propan-2-ylidene)hydrazin-1-yl]-1??,2-benzothiazole-1,1-dione

3-[1-methyl-2-(propan-2-ylidene)hydrazin-1-yl]-1??,2-benzothiazole-1,1-dione

Formula: C11H13N3O2S

SMILES: CN(N=C(C)C)C1=NS(=O)(=O)C2=C1C=CC=C2

IUPAC: 3-[1-methyl-2-(propan-2-ylidene)hydrazin-1-yl]-1??,2-benzothiazole-1,1-dione

InChI: InChI=1S/C11H13N3O2S/c1-8(2)12-14(3)11-9-6-4-5-7-10(9)17(15,16)13-11/h4-7H,1-3H3

Composition: C (52.57%), H (5.21%), N (16.72%), O (12.73%), S (12.76%)

Molar Mass: 251.3

Atom Count: 30

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 251.072847845
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey XOXXHUMSMRFPJJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.8
Topological Polar Surface Area 62.1
Polarizability 25.54
Ring Count 2
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H13N3O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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