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2-chloro-N-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

2-chloro-N-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

Formula: C11H14ClNOS

SMILES: CSC1=CC=C(CN(C)C(=O)CCl)C=C1

IUPAC: 2-chloro-N-methyl-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

InChI: InChI=1S/C11H14ClNOS/c1-13(11(14)7-12)8-9-3-5-10(15-2)6-4-9/h3-6H,7-8H2,1-2H3

Composition: C (54.20%), H (5.79%), Cl (14.54%), N (5.75%), O (6.56%), S (13.15%)

Molar Mass: 243.75

Atom Count: 29

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 243.0484629
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey FUPYLSPCVMCPQP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.38
Topological Polar Surface Area 20.31
Polarizability 25.61
Ring Count 1
Rotatable Bond Count 4

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Purity (%)
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Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C11H14ClNOS Quote Only