3-Methyl-4-methylthiophenol

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Names

[ CAS No. ]:
3120-74-9

[ Name ]:
3-Methyl-4-methylthiophenol

[Synonym ]:
3-methyl-4-methylsulfanylphenol
MFCD00045773
3-CH3-4-CH3S-C6H3OH
4-(Methylsulfanyl)-m-cresol
3-Methyl-4-(methylsulfanyl)phenol
QR C1 DS1
USAF MA-17
4-(Methylthio)-m-cresol
EINECS 221-496-7
3-Methyl-4-methylthiophenol
MMTP
Phenol, 3-methyl-4-(methylthio)-
Methylthiomethylphenol

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
263.5±33.0 °C at 760 mmHg

[ Melting Point ]:
56-60°C

[ Molecular Formula ]:
C8H10OS

[ Molecular Weight ]:
154.229

[ Flash Point ]:
128.7±24.1 °C

[ Exact Mass ]:
154.045242

[ PSA ]:
45.53000

[ LogP ]:
2.27

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.597

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GP2225000
CHEMICAL NAME :
m-Cresol, 4-(methylthio)-
CAS REGISTRY NUMBER :
3120-74-9
BEILSTEIN REFERENCE NO. :
1210322
LAST UPDATED :
199701
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C8-H10-O-S
MOLECULAR WEIGHT :
154.24
WISWESSER LINE NOTATION :
QR C1 DS1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3400 mg/kg
TOXIC EFFECTS :
Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - true cholinesterase
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 43(8),10,1978
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - true cholinesterase
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 43(8),10,1978
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD438-895
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
3500 mg/kg
TOXIC EFFECTS :
Biochemical - Enzyme inhibition, induction, or change in blood or tissue levels - true cholinesterase
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 43(8),10,1978 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 2 mg/m3;Skin JAN 1993

Safety Information

[ Symbol ]:

GHS05, GHS07

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H315-H318-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R22;R37/38;R41

[ Safety Phrases ]:
S26-S36/39

[ RIDADR ]:
3335

[ RTECS ]:
GP2225000

[ HS Code ]:
2930909090

Synthetic Route

Precursor & DownStream

Precursor

  • 4-METHOXY-2-METHYL-1-METHYLSULFANYL-BENZENE
  • 4-Methoxy-2-methylbenzenethiol
  • Dimethyl disulfide
  • m-Cresol
  • 3-methyl-4-methylsulfanylaniline
  • (4-hydroxy-2-methyl-phenyl)-dimethyl sulfonium , chloride
  • Methanesulfenic acid chloride
  • 2-methyl-4-hydroxy-mercaptobenzene
  • Hydrogen bromide
  • acetic acid

DownStream

  • 3-methyl-4-methylsulfonylphenol
  • 4-METHOXY-2-METHYL-1-METHYLSULFANYL-BENZENE
  • Diisopropylamine
  • 2-(3-methyl-4-methylsulfanylphenoxy)acetic acid
  • Phenol, 3-methyl-4-(methylsulfinyl)-
  • fenamiphos
  • fenthion-oxon
  • 3-(3-methyl-4-methylsulfanylphenoxy)pyridine-4-carbonitrile
  • (3-methyl-4-methylsulfanylphenyl) trifluoromethanesulfonate

Customs

[ HS Code ]: 2930909090

[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Related Compounds

  • 3-methyl-4-methylthiophenol
  • 3-methyl-4-methylthiophenol
  • 3-methyl-4-[4-(4-methyl-1,2,5-oxadiazol-3-yl)piperazin-1-yl]-1,2,5-oxadiazole
  • 3-methyl-4-[4-(4-methyl-1,2,5-oxadiazol-3-yl)-1,4-diazepan-1-yl]-1,2,5-oxadiazole
  • 3-[methyl(4-prop-2-enoyloxybutoxy)phosphoryl]propanoic acid
  • 3-methyl-4-trimethoxysilylbutan-1-amine
  • Methyl 2-(4-(2-methylallyl)morpholin-2-yl)acetate
  • 4-(4-Benzylpiperazin-1-yl)-2-bromonitrobenzene
  • Tert-butyl (1-((2-chlorobenzyl)sulfonyl)piperidin-3-yl)(methyl)carbamate
  • 4-(Isopropyl(methyl)amino)-2-methylbutan-2-ol
  • 3-Amino-3-(2,6-difluorophenyl)propanoic acid hydrochloride
  • 3-Amino-3-(2,4-difluorophenyl)propanoic acid hydrochloride
  • 1-(6-chloropyridazin-3-yl)-N-(piperidin-4-ylmethyl)methanamine hydrochloride
  • Tert-butyl 2-amino-3-hydroxy-3-phenylpropanoate
  • 4-(Difluoromethyl)pyrrolidine-3-carboxylic acid
  • 4-((2-Hydroxyethyl)amino)-2-methylbutan-2-ol
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