2(3H)-Benzoxazolethione,6-methyl-

• CAS: 23417-29-0
• Catalog Number: ACM23417290
• Category: Other Products
• Molecular Weight: 165.2123
• Molecular Formula: C8H7 N O S
• Synonyms: 23417-29-0, NSC332173, AC1LIWO2, SureCN2538594, MolPort-002-917-799, HMS1667P02, ZINC00574162, AKOS003573636, AB03206, NSC-332173, 6-methyl-3H-1,3-benzoxazole-2-thione, 6-METHYLBENZO[D]OXAZOLE-2-THIOL, 6-METHYL-1,3-BENZOXAZOLE-2-THIOL, S06035, 6-methyl-2,3-dihydro-1,3-benzoxazole-2-thione
• IUPAC Name: 6-methyl-3H-1,3-benzoxazole-2-thione
• Canonical SMILES: CC1=CC2=C(C=C1)NC(=S)O2
• InChI Key: NUMDWMDMUXZMHA-UHFFFAOYSA-N
• Boiling Point: 270.5ºC at 760mmHg
• Flash Point: 117.4ºC
• Density: 1.34g/cm³
• Exact Mass: 165.02500
• H-Bond Acceptor: 2
• H-Bond Donor: 1

Synthetic Use

Upstream Synthesis Route 1

• 140-89-6
• 2835-98-5

• 23417-29-0

Reference: [1]Location in patent: experimental part
Deligeorgiev, Todor G.; Kaloyanova, Stefka S.; Lesev, Nedyalko Y.; Vaquero, Juan J.
[Monatshefte fur Chemie, 2011, vol. 142, # 9, p. 895 - 899]

Downstream Synthesis Route 1

• 23417-29-0
• 6959-48-4

• 88594-58-5

Reference: [1]Schickaneder, Helmut; Engler, Heidrun; Szelenyi, Istvan
[Journal of Medicinal Chemistry, 1987, vol. 30, # 3, p. 547 - 551]

Downstream Synthesis Route 2

• 23417-29-0

• 3621-83-8

Reference: [1]Current Patent Assignee: PIERRE FABRE PARCIPATIONS - WO2012/69503, 2012, A1
Location in patent: Page/Page column 19-20

* For details of the synthesis route, please refer to the original source to ensure accuracy.