1,3-Diisopropylthiourea

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Names

[ CAS No. ]:
2986-17-6

[ Name ]:
1,3-Diisopropylthiourea

[Synonym ]:
N,N'-Diisopropylcarbamimidothioic acid
Diisopropyl thiourea
MFCD00040485
Methanethiol, 1-[(1-methylethyl)amino]-1-[(1-methylethyl)imino]-, (E)-
N,N-Diisopropylthiourea
N,N'-Diisopropylthiourea
N,N'-Diisoprop thiourea
1,3-Diisopropyl-2-thiourea
1,3-Diisopropylthiourea
Thiourea, N,N'-bis(1-methylethyl)-
UREA,1,3-DIISOPROPYL-2-THIO
EINECS 221-051-7

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
201.0±23.0 °C at 760 mmHg

[ Melting Point ]:
143-145 °C(lit.)

[ Molecular Formula ]:
C7H16N2S

[ Molecular Weight ]:
160.280

[ Flash Point ]:
75.4±22.6 °C

[ Exact Mass ]:
160.103424

[ PSA ]:
56.15000

[ LogP ]:
2.53

[ Vapour Pressure ]:
0.3±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.507

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YS9860000
CHEMICAL NAME :
Urea, 1,3-diisopropyl-2-thio-
CAS REGISTRY NUMBER :
2986-17-6
BEILSTEIN REFERENCE NO. :
0605861
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C7-H16-N2-S
MOLECULAR WEIGHT :
160.31
WISWESSER LINE NOTATION :
1Y1&MYUS&MY1&1

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 :
450 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 90,260,1947
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1070 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: 14,111,1985

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302

[ Precautionary Statements ]:
P301 + P312 + P330

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges

[ Hazard Codes ]:
T:Toxic;

[ Risk Phrases ]:
R23/24/25

[ Safety Phrases ]:
S27-S28-S36/37/39-S45

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
YS9860000

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Disodium carbonotrithioate
  • isopropylamine
  • N,N′-diisopropylcarbodiimide
  • propan-2-amine; (propan-2-ylamino)methanedithioic acid
  • Carbon disulphide
  • Isopropyl isothiocyanate
  • o-Phenylenediamine

DownStream

  • N,N′-diisopropylcarbodiimide
  • ISOPROPYL-(1-ISOPROPYL-1H-TETRAZOL-5-YL)-AMINE
  • 1,3-Diisopropylurea

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

  • 1,3-dimethyl-2H-pyrazolo[3,4-d]pyrimidine-4,6-dione
  • 1,3,5-Triazine-2,4(1H,3H)-dione, 1-acetyldihydro- (9CI)
  • 1,3-Dioxolan-4-one,5-methyl-2-propyl-
  • 1,3-Methano-1H-cyclopenta[b]quinoxaline,2,3-dihydro-(9CI)
  • 1-(3-phenylbut-3-enyl)piperidine
  • 1,3-Propanedione,1,3-diphenyl-2-(phenylmethylene)-
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-{7-Oxabicyclo[2.2.1]heptan-2-yl}propan-1-amine
  • 3-(Hydroxymethyl)-3-methylthietane 1,1-dioxide
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • (1S)-1-Amino-1-(4-chloro-3-methylphenyl)propan-2-OL
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde