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104-85-8

104-85-8 structure
104-85-8 structure

Name p-Tolunitrile
Synonyms 4-Methylbenzyl cycnide
p-Tolunitril
p-Tolunitrile
p-Tolumitrile
MFCD00001827
Benzonitrile, 4-methyl-
CNT
4-Methylbenzonitrile
4-Cyanotoluene
p-Tolylnitrile
p-toluonitrile
4-TOLUNITRILE
P-Tounitrile
p-Toluonitril
EINECS 203-244-8
Density 1.0±0.1 g/cm3
Boiling Point 218.4±9.0 °C at 760 mmHg
Melting Point 26-28 °C(lit.)
Molecular Formula C8H7N
Molecular Weight 117.148
Flash Point 85.6±11.2 °C
Exact Mass 117.057846
PSA 23.79000
LogP 2.12
Vapour Pressure 0.1±0.4 mmHg at 25°C
Index of Refraction 1.531
Stability Stable. Incompatible with strong oxidizing agents, strong bases.
Water Solubility <0.1 g/100 mL at 17 ºC

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XV0700000
CHEMICAL NAME :
p-Tolunitrile
CAS REGISTRY NUMBER :
104-85-8
LAST UPDATED :
199707
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C8-H7-N
MOLECULAR WEIGHT :
117.16
WISWESSER LINE NOTATION :
NCR D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,904,1986
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,904,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3800 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ZAARAM Zentralblatt fuer Arbeitsmedizin und Arbeitsschutz. (Darmstadt, Fed. Rep. Ger.) V.1-25, 1951-75. Volume(issue)/page/year: 19,225,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ZAARAM Zentralblatt fuer Arbeitsmedizin und Arbeitsschutz. (Darmstadt, Fed. Rep. Ger.) V.1-25, 1951-75. Volume(issue)/page/year: 19,225,1969
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
1080 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Lungs, Thorax, or Respiration - dyspnea Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 5,161,1899
Symbol GHS07 GHS08
GHS07, GHS08
Signal Word Danger
Hazard Statements H315-H319-H334-H335
Precautionary Statements P261-P305 + P351 + P338-P342 + P311
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Faceshields;Gloves
Hazard Codes Xi:Irritant
Risk Phrases R36/38
Safety Phrases S26-S36/37-S37
RIDADR NONH for all modes of transport
WGK Germany 2
RTECS XV0700000
Packaging Group I; II
Hazard Class 6.1
HS Code 29269095
HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%