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1-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

1-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Formula: C11H10N2O2S

SMILES: CC1=CC=CC=C1N1C(=O)CC(=O)NC1=S

IUPAC: 1-(2-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

InChI: InChI=1S/C11H10N2O2S/c1-7-4-2-3-5-8(7)13-10(15)6-9(14)12-11(13)16/h2-5H,6H2,1H3,(H,12,14,16)

Composition: C (56.40%), H (4.30%), N (11.96%), O (13.66%), S (13.68%)

Molar Mass: 234.27

Atom Count: 26

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 234.046298744
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NPFGZOYYBFVWAE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.68
Topological Polar Surface Area 49.41
Polarizability 24.58
Ring Count 2
Rotatable Bond Count 1

Suppliers

Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C11H10N2O2S Quote Only
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H10N2O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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