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4553-62-2

4553-62-2 structure
4553-62-2 structure
  • Name: 2-Methylglutaronitrile
  • Chemical Name: 2-Methylglutaronitrile
  • CAS Number: 4553-62-2
  • Molecular Formula: C6H8N2
  • Molecular Weight: 108.14100
  • Create Date: 2018-08-13 21:07:28
  • Modify Date: 2024-01-01 21:33:14

Name 2-Methylglutaronitrile
Synonyms 1,3-Dicyanobutane
MFCD00001875
2-METHYLGLUTARONITRILE
EINECS 224-923-5
2-methylpentanedinitrile
Density 0.95 g/mL at 25 °C(lit.)
Boiling Point 269-271 °C(lit.)
Melting Point −45 °C(lit.)
Molecular Formula C6H8N2
Molecular Weight 108.14100
Flash Point >230 °F
Exact Mass 108.06900
PSA 47.58000
LogP 1.44986
Index of Refraction n20/D 1.434(lit.)

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YV8140000
CHEMICAL NAME :
1,5-Valerodinitrile, 2-methyl-
CAS REGISTRY NUMBER :
4553-62-2
BEILSTEIN REFERENCE NO. :
1741955
LAST UPDATED :
199712
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C6-H8-N2
MOLECULAR WEIGHT :
108.16
WISWESSER LINE NOTATION :
NCYU1&2CN

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 :
400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
34 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - excitement Lungs, Thorax, or Respiration - cyanosis

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
1 mg/plate
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 11(Suppl 12),1,1988
Symbol GHS06
GHS06
Signal Word Danger
Hazard Statements H301 + H311-H330
Precautionary Statements P260-P280-P284-P301 + P310-P310
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes Xn
Risk Phrases R20/21/22
Safety Phrases S36/37
RIDADR 3276
WGK Germany 3
RTECS YV8140000
Packaging Group III
Hazard Class 6.1(b)
HS Code 2926909090
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%