1-Phenyl-5-mercaptotetrazole

Suppliers

Names

[ CAS No. ]:
86-93-1

[ Name ]:
1-Phenyl-5-mercaptotetrazole

[Synonym ]:
5-Mercapto-1-phenyl-1H-tetrazole
1-Phenyltetrazol-5-thiol
5-mercapto-1-phenyltetrazole
1-phenyl-5-mercapto-1H-tetrazole
5-mercapto-1-phenyl-1,2,3,4-tetrazole
1-phenyl-1H-tetrazole-5-thiol
Phenylmercaptotetrazole
Phenyltetrazolethiol
EINECS 201-710-5
Mercaptophenyltetrazole
1-Phenyltetrazole-5
1-Phenyl-5-mercapto
1-Phenyl-1,2-dihydro-5H-tetrazole-5-thione
1-Phenyl-5-mercaptotetrazole
1H-Tetrazole-5-thiol, 1-phenyl-
PMT
1-phenyl-5-sulfanyltetrazole
MFCD00003129
5H-tetrazole-5-thione, 1,2-dihydro-1-phenyl-
1-phenyl-1H-1,2,3,4-tetraazole-5-thiol
1-Phenyltetrazolethiol
1-PHENYL-5-MERCAPT-1H-TETRAZOLE

Chemical & Physical Properties

[ Density]:
1.5±0.1 g/cm3

[ Boiling Point ]:
340.2±25.0 °C at 760 mmHg

[ Melting Point ]:
145 °C (dec.)(lit.)

[ Molecular Formula ]:
C7H6N4S

[ Molecular Weight ]:
178.214

[ Flash Point ]:
159.5±23.2 °C

[ Exact Mass ]:
178.031311

[ PSA ]:
82.40000

[ LogP ]:
2.31

[ Vapour Pressure ]:
0.0±0.7 mmHg at 25°C

[ Index of Refraction ]:
1.761

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XF7700000
CHEMICAL NAME :
1H-Tetrazole-5-thiol, 1-phenyl-
CAS REGISTRY NUMBER :
86-93-1
LAST UPDATED :
199701
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C7-H6-N4-S
MOLECULAR WEIGHT :
178.23
WISWESSER LINE NOTATION :
T5NNNNJ AR& ESH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1750 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 24(1),55,1980
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
250 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: AD691-490 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M1232 No. of Facilities: 18 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 72 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M1232 No. of Facilities: 4468 (estimated) No. of Industries: 24 No. of Occupations: 22 No. of Employees: 26699 (estimated) No. of Female Employees: 12225 (estimated)

Safety Information

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R5;R22

[ Safety Phrases ]:
S22-S24/25

[ RIDADR ]:
UN 1325 4.1/PG 2

[ WGK Germany ]:
1

[ RTECS ]:
XF7700000

[ Packaging Group ]:
III

[ Hazard Class ]:
4.1

[ HS Code ]:
29339990

Synthetic Route

Precursor & DownStream

Precursor

  • Phenyl isothiocyanate
  • N-Hydroxy-N,N2,N2-trimethylglycinamide
  • 3-((1-phenyl-1H-tetrazol-5-yl)thio)isobenzofuran-1(3H)-one
  • 1,2,3,4-Thiatriazol-5-amine,N-phenyl-
  • bis[(1-phenyltetrazol-5-yl)sulfanyl]methanone
  • o-Phenylenediamine
  • aminophenol
  • 2-Amino-4-chlorophenol
  • 2-Amino-3-pyridinol
  • 4-phenyl-3-thiosemicarbazide

DownStream

  • 1-Phenyl-1H-tetrazole
  • 5-(Methylthio)-1-phenyl-1H-tetrazole
  • 1-methyl-4-phenyltetrazole-5-thione
  • 2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]anthracene-9,10-dione
  • 5-pentylsulfonyl-1-phenyltetrazole
  • 5-bromo-1-phenyl-tetrazole
  • 5,5'-(Methylenebisthio)bis(1-phenyl-1H-tetrazole)
  • AKOS BC-3167
  • 1-Phenyl-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethanone
  • 5,5'-Dithiobis(1-phenyl-1H-tetrazole)

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%


Related Compounds

  • 1-phenyl-5-mercaptotetrazole sodium salt
  • 1-PHENYL-5-TRIFLUOROMETHYL-1H-PYRAZOLE-4-CARBOXYLICACIDETHYLESTER
  • 1-phenyl-5-[6-(1-phenyltetrazol-5-yl)sulfanylhexylsulfanyl]tetrazole
  • 1-phenyl-5-propoxypyrazole-3-carboxylic acid
  • 1-phenyl-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-3-one
  • 1-phenyl-5-trimethylsilylpent-1-en-4-yn-3-one