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4886-77-5

4886-77-5 structure
4886-77-5 structure
  • Name: 3-METHYLTHIOANISOLE
  • Chemical Name: 1-methyl-3-methylsulfanylbenzene
  • CAS Number: 4886-77-5
  • Molecular Formula: C8H10S
  • Molecular Weight: 138.23000
  • Create Date: 2018-09-13 17:36:26
  • Modify Date: 2025-08-25 10:32:56
Name 1-methyl-3-methylsulfanylbenzene
Synonyms 3-Methylthioanisole
3-Methyl methylthiophenol
Methyl-m-tolyl-sulfid
m-Methylthioanisole
m-CH3C6H4SCH3
m-tolylmethylsulfide
SULFIDE,METHYL m-TOLYL
3-Methylthiotoluene
Methyl m-tolyl sulfide
Density 1.01 g/cm3
Boiling Point 199.6ºC at 760 mmHg
Molecular Formula C8H10S
Molecular Weight 138.23000
Flash Point 73.6ºC
Exact Mass 138.05000
PSA 25.30000
LogP 2.71690
Index of Refraction 1.558

CHEMICAL IDENTIFICATION

RTECS NUMBER :
WQ5550000
CHEMICAL NAME :
Sulfide, methyl m-tolyl
CAS REGISTRY NUMBER :
4886-77-5
BEILSTEIN REFERENCE NO. :
2040355
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H10-S
MOLECULAR WEIGHT :
138.24
WISWESSER LINE NOTATION :
1SR C1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intracerebral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
13 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCBPBS Pesticide Biochemistry and Physiology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1971- Volume(issue)/page/year: 8,302,1978
624-92-0 structure

624-92-0

28987-79-3 structure

28987-79-3

~68%

4886-77-5 structure

4886-77-5

Literature: ELI LILLY AND COMPANY Patent: WO2004/9086 A1, 2004 ; Location in patent: Page/Page column 45 ; WO 2004/009086 A1
33733-73-2 structure

33733-73-2

74-88-4 structure

74-88-4

~77%

4886-77-5 structure

4886-77-5

Literature: Cabiddu, Maria G.; Cabiddu, Salvatore; Cadoni, Enzo; De Montis, Stefania; Fattuoni, Claudia; Melis, Stefana Tetrahedron, 2004 , vol. 60, # 17 p. 3915 - 3920
625-95-6 structure

625-95-6

67-68-5 structure

67-68-5

~95%

4886-77-5 structure

4886-77-5

Literature: Luo, Fang; Pan, Changduo; Li, Liping; Chen, Fan; Cheng, Jiang Chemical Communications, 2011 , vol. 47, # 18 p. 5304 - 5306
108-40-7 structure

108-40-7

77-78-1 structure

77-78-1

~%

4886-77-5 structure

4886-77-5

Literature: Chazin, Walter J.; Colebrook, Lawrence D. Magnetic Resonance in Chemistry, 1985 , vol. 23, # 7 p. 597 - 604
108-40-7 structure

108-40-7

~%

4886-77-5 structure

4886-77-5

Literature: Tanimoto, Shigeo; Oida, Tatsuo; Ikehira, Hideyuki; Okano, Masaya Bulletin of the Chemical Society of Japan, 1982 , vol. 55, # 6 p. 1977 - 1978
108-40-7 structure

108-40-7

74-88-4 structure

74-88-4

~%

4886-77-5 structure

4886-77-5

Literature: Hendriks, Christine M. M.; Lamers, Philip; Engel, Julien; Bolm, Carsten Advanced Synthesis and Catalysis, 2013 , vol. 355, # 17 p. 3363 - 3368
3996-30-3 structure

3996-30-3

~%

4886-77-5 structure

4886-77-5

Literature: Gnanaraj; Rajagopal; Srinivasan Tetrahedron, 1994 , vol. 50, # 31 p. 9447 - 9456
108-40-7 structure

108-40-7

6257-10-9 structure

6257-10-9

~%

4886-77-5 structure

4886-77-5

Literature: Vowinkel,E. Synthesis, 1974 , p. 430 - 432
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