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6-methyl-2-{[4-(methylsulfanyl)phenyl]methyl}-1,3-benzoxazole

6-methyl-2-{[4-(methylsulfanyl)phenyl]methyl}-1,3-benzoxazole

Formula: C16H15NOS

SMILES: CSC1=CC=C(CC2=NC3=CC=C(C)C=C3O2)C=C1

IUPAC: 6-methyl-2-{[4-(methylsulfanyl)phenyl]methyl}-1,3-benzoxazole

InChI: InChI=1S/C16H15NOS/c1-11-3-8-14-15(9-11)18-16(17-14)10-12-4-6-13(19-2)7-5-12/h3-9H,10H2,1-2H3

Composition: C (71.34%), H (5.61%), N (5.20%), O (5.94%), S (11.90%)

Molar Mass: 269.36

Atom Count: 34

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 269.087435281
Formal Charge 0
FSP3 0.19
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey MZCUSFGISSIQFQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.69
Topological Polar Surface Area 26.03
Polarizability 31.87
Ring Count 3
Rotatable Bond Count 3

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C16H15NOS $1,541.00-$2,420.00$1,541.00$1,920.00$2,420.00
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