4-(Methylmercapto)aniline

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Names

[ CAS No. ]:
104-96-1

[ Name ]:
4-(Methylmercapto)aniline

[Synonym ]:
4-(Methylthio)aniline
4-(Methylmercapto)aniline
Benzenamine, 4-(methylthio)-
MFCD00007889
4-(Methylsulfanyl)aniline
4-Aminothioanisole
4-methylsulfanylaniline
p-Thioanisidine
EINECS 203-256-3

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
273.3±13.0 °C at 760 mmHg

[ Melting Point ]:
156 - 158ºC

[ Molecular Formula ]:
C7H9NS

[ Molecular Weight ]:
139.218

[ Flash Point ]:
119.1±19.8 °C

[ Exact Mass ]:
139.045563

[ PSA ]:
51.32000

[ LogP ]:
1.32

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

[ Index of Refraction ]:
1.612

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
BY6302000
CHEMICAL NAME :
Aniline, p-(methylthio)-
CAS REGISTRY NUMBER :
104-96-1
BEILSTEIN REFERENCE NO. :
0774506
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C7-H9-N-S

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Bird - quail
DOSE/DURATION :
562 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AECTCV Archives of Environmental Contamination and Toxicology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 070944) V.1- 1973- Volume(issue)/page/year: 12,355,1983 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83226 No. of Facilities: 21 (estimated) No. of Industries: 1 No. of Occupations: 19 No. of Employees: 2446 (estimated)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

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

[ Personal Protective Equipment ]:
Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22;R36/37/38

[ Safety Phrases ]:
S26-S36-S37/39

[ RIDADR ]:
2810

[ WGK Germany ]:
3

[ RTECS ]:
BY6302000

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-nitrophenyl methyl sulfide
  • 4-Bromothioanisole
  • 4-Chlorophenyl methyl sulfide
  • 4-thioanisolemagnesium bromide
  • 4-(Methylthio)phenylboronic acid
  • 1-methylsulfinyl-4-nitro-benzene
  • Dimethyl disulfide
  • 2-(2-methoxyethoxy)ethyl methyl carbonate
  • 4-Aminothiophenol

DownStream

  • 4-(Methylsulfonyl)aniline
  • 4-Methylsulfonyl benzoic acid
  • 4-Fluoro thioanisole
  • 2-Phenylacetophenone
  • 1-FLUORO-4-(TRIFLUOROMETHYLTHIO)BENZENE
  • 4-Iodophenyl methyl sulfide
  • Thioanisole
  • 4-methylsulfanyl-N-(propan-2-ylsulfamoyl)aniline
  • 4-Acetamidothioanisole
  • 4-Hydroxythioanisole

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%

Related Compounds

  • 2-Fluoro-4-(methylmercapto)aniline
  • 4-(METHYLMERCAPTO)ANILINE HYDROCHLORIDE
  • 3-(Methylmercapto)aniline
  • 3-methyl-4-methylsulfanylaniline
  • 2-amino-4-methylphenyl methyl sulphide
  • N,N-BIS(2-CHLOROETHYL)-4-METHYLTHIOANILINE
  • tert-butyl N-methyl-N-[1-(2-oxo-1,3-oxazolidin-5-yl)ethyl]carbamate
  • 2-[5-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanoyl]-4-methyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid
  • 4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-{[(6-methyloxan-2-yl)methyl]carbamoyl}butanoic acid
  • 4-(3,3-diethylpiperidin-1-yl)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-oxobutanoic acid
  • 2-[4-(Aminomethyl)-4-phenylpiperidine-1-carbonyl]-4-methylmorpholin-3-one
  • 3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-[({3-oxabicyclo[3.1.0]hexan-1-yl}methyl)carbamoyl]propanoic acid
  • 1-{[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,3-dimethylbutanamido]methyl}cyclobutane-1-carboxylic acid
  • 2-ethyl-2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,3-dimethylbutanamido]butanoic acid
  • O-[2-(2-methoxy-4-methylphenyl)propan-2-yl]hydroxylamine
  • 3-cyclopropyl-3-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,3-dimethylbutanamido]propanoic acid
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