1,3-Diisopropylthiourea

Modify Date: 2024-01-06 16:57:18

1,3-Diisopropylthiourea Structure
1,3-Diisopropylthiourea structure
 Common Name 1,3-Diisopropylthiourea
CAS Number 2986-17-6 Molecular Weight 160.280
Density 1.0±0.1 g/cm3 Boiling Point 201.0±23.0 °C at 760 mmHg
Molecular Formula C7H16N2S Melting Point 143-145 °C(lit.)
MSDS Chinese USA Flash Point 75.4±22.6 °C
Symbol GHS07
GHS07		 Signal Word Warning

 Names

Name 1,3-di(propan-2-yl)thiourea
Synonym More Synonyms

 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

 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
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

Disodium carbonotrithioate structure

Disodium carbon...

CAS#:534-18-9

isopropylamine structure

isopropylamine

CAS#:75-31-0

~67%

2(1H)-Pyridinethione,1-methyl- structure

2(1H)-Pyridinet...

CAS#:2044-27-1

1,3-Diisopropylthiourea Structure

1,3-Diisopropyl...

CAS#:2986-17-6

Literature: Chemistry Letters, , p. 641 - 642
N,N′-diisopropylcarbodiimide structure

N,N′-diisopropy...

CAS#:693-13-0

~%

1,3-Diisopropylthiourea Structure

1,3-Diisopropyl...

CAS#:2986-17-6

Literature: Journal of Heterocyclic Chemistry, , vol. 16, p. 341 - 345
propan-2-amine; (propan-2-ylamino)methanedithioic acid structure

propan-2-amine;...

CAS#:16486-30-9

~%

1,3-Diisopropylthiourea Structure

1,3-Diisopropyl...

CAS#:2986-17-6

Literature: Chemische Berichte, , vol. 100, # 5 p. 1602 - 1615
isopropylamine structure

isopropylamine

CAS#:75-31-0

~%

1,3-Diisopropylthiourea Structure

1,3-Diisopropyl...

CAS#:2986-17-6

Literature: Chemische Berichte, , vol. 74, p. 1288 Anm.10
Carbon disulphide structure

Carbon disulphide

CAS#:75-15-0

isopropylamine structure

isopropylamine

CAS#:75-31-0

~%

1,3-Diisopropylthiourea Structure

1,3-Diisopropyl...

CAS#:2986-17-6

Literature: US2849420 , ;
Isopropyl isothiocyanate structure

Isopropyl isoth...

CAS#:2253-73-8

isopropylamine structure

isopropylamine

CAS#:75-31-0

~%

1,3-Diisopropylthiourea Structure

1,3-Diisopropyl...

CAS#:2986-17-6

Literature: Justus Liebigs Annalen der Chemie, , vol. 722, p. 52 - 79 Journal of Organic Chemistry, , vol. 12, p. 440 Anm.6
Isopropyl isothiocyanate structure

Isopropyl isoth...

CAS#:2253-73-8

o-Phenylenediamine structure

o-Phenylenediamine

CAS#:95-54-5

~%

2-Mercaptobenzimidazole structure

2-Mercaptobenzi...

CAS#:583-39-1

1,3-Diisopropylthiourea Structure

1,3-Diisopropyl...

CAS#:2986-17-6

Literature: Chemistry - A European Journal, , vol. 16, # 35 p. 10818 - 10831
Carbon disulphide structure

Carbon disulphide

CAS#:75-15-0

isopropylamine structure

isopropylamine

CAS#:75-31-0

~%

Isopropyl isothiocyanate structure

Isopropyl isoth...

CAS#:2253-73-8

1,3-Diisopropylthiourea Structure

1,3-Diisopropyl...

CAS#:2986-17-6

Literature: Monatshefte fuer Chemie, , vol. 3, p. 172 Chemische Berichte, , vol. 8, p. 805

 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%

 Synonyms

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
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