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N-phenyl-3-sulfanylpropanamide

N-phenyl-3-sulfanylpropanamide

CAS: 10220-66-3

Formula: C9H11NOS

SMILES: SCCC(=O)NC1=CC=CC=C1

IUPAC: N-phenyl-3-sulfanylpropanamide

InChI: InChI=1S/C9H11NOS/c11-9(6-7-12)10-8-4-2-1-3-5-8/h1-5,12H,6-7H2,(H,10,11)

Composition: C (59.64%), H (6.12%), N (7.73%), O (8.83%), S (17.69%)

Molar Mass: 181.25

Atom Count: 23

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 181.056135152
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey YSPHRFZMBKXSAX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.35
Topological Polar Surface Area 29.1
Polarizability 20.1
Ring Count 1
Rotatable Bond Count 3

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OTAVA LTD.
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Purity LeadTime CAS PacketSize UnitPrice
95% <10 Days 10220-66-3 $134.90-$296.18$134.90$181.82$296.18
MFCD16469236
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Key Organics Ltd
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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 10220-66-3 $297.16-$509.11$297.16$297.16$359.43$359.43$509.11$509.11
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