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1-(benzenesulfonyl)propan-2-one

1-(benzenesulfonyl)propan-2-one

Formula: C9H10O3S

SMILES: CC(=O)CS(=O)(=O)C1=CC=CC=C1

IUPAC: 1-(benzenesulfonyl)propan-2-one

InChI: InChI=1S/C9H10O3S/c1-8(10)7-13(11,12)9-5-3-2-4-6-9/h2-6H,7H2,1H3

Composition: C (54.53%), H (5.08%), O (24.21%), S (16.17%)

Molar Mass: 198.24

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 198.035065356
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey YBLGSNMIIPIRFC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.45
Topological Polar Surface Area 51.21
Polarizability 20.08
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
OTAVA LTD.
Purity LeadTime Formula PacketSize UnitPrice
95% <10 Days C9H10O3S $162.27$162.27
MFCD00047794
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AA BLOCKS INC
Purity LeadTime Formula PacketSize UnitPrice
98% <6 Days C9H10O3S $11.50-$1,334.00$11.50$23.00$42.55$105.80$287.50$1,334.00
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Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
97% <7 Days C9H10O3S $14.49-$393.30$14.49$35.19$128.34$393.30
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Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
98% <5 Days C9H10O3S $13.87-$518.27$13.87$32.79$71.88$177.80$518.27
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Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C9H10O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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