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methyl 2-[(triphenylmethyl)sulfanyl]acetate

methyl 2-[(triphenylmethyl)sulfanyl]acetate

Formula: C22H20O2S

SMILES: COC(=O)CSC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: methyl 2-[(triphenylmethyl)sulfanyl]acetate

InChI: InChI=1S/C22H20O2S/c1-24-21(23)17-25-22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,17H2,1H3

Composition: C (75.83%), H (5.79%), O (9.18%), S (9.20%)

Molar Mass: 348.46

Atom Count: 45

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 348.118401058
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey MVUPACKEURZFOJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 105.09
Topological Polar Surface Area 26.3
Polarizability 40.75
Ring Count 3
Rotatable Bond Count 7

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Purity (%)
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Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C22H20O2S Quote Only