ChemicalBook--->CAS DataBase List--->105-55-5

105-55-5

105-55-5 Structure

105-55-5 Structure
IdentificationMore
[Name]

N,N'-Diethylthiourea
[CAS]

105-55-5
[Synonyms]

1,3-DIETHYL-2-THIOUREA
1,3-DIETHYLTHIOUREA
DETU
DIETHYL THIOUREA
N,N'-DIETHYL-2-THIOUREA
N,N′-Diethylthiocarbamide
N,N'-DIETHYLTHIOUREA
SYM-DIETHYLTHIOUREA
THIATE H
1,3-diethyl-2-thio-ure
1,3-diethyl-2-thiourea[qr]
1,3-diethyl-2-thiouree
1,3-diethylthiourea[qr]
n,n’-diethylthiocarbamide[qr]
n,n’-diethyl-thioure
n,n’-diethylthiouree
N,N'-Diethylthiourea (sym)
NCI-C03816
nci-c03816[qr]
Pennzone E
[EINECS(EC#)]

203-308-5
[Molecular Formula]

C5H12N2S
[MDL Number]

MFCD00004925
[Molecular Weight]

132.23
[MOL File]

105-55-5.mol
Chemical PropertiesBack Directory
[Appearance]

white to buff-coloured solid
[Melting point ]

76-78 °C(lit.)
[Boiling point ]

245°C (estimate)
[bulk density]

735kg/m3
[density ]

1,12 g/cm3
[vapor pressure ]

0.001Pa at 25℃
[refractive index ]

1.5300 (estimate)
[Fp ]

186 °C
[storage temp. ]

Store below +30°C.
[solubility ]

42g/l
[form ]

solid
[pka]

14.47±0.70(Predicted)
[color ]

White to Off-White
[PH]

7 (38g/l, H2O, 20℃)
[Stability:]

Stable. May be air sensitive. Incompatible with strong oxidizing agents.
[Water Solubility ]

38 g/L (20 ºC)
[BRN ]

773905
[Henry's Law Constant]

1.4×102 mol/(m3Pa) at 25℃, HSDB (2015)
[InChI]

1S/C5H12N2S/c1-3-6-5(8)7-4-2/h3-4H2,1-2H3,(H2,6,7,8)
[Contact allergens]

Diethylthiourea, a thiourea derivative, is used mainly as a rubber chemical, particularly in solid neoprene products.
[InChIKey]

FLVIGYVXZHLUHP-UHFFFAOYSA-N
[SMILES]

CCNC(=S)NCC
[LogP]

0.57
[CAS DataBase Reference]

105-55-5(CAS DataBase Reference)
[IARC]

3 (Vol. 79) 2001
[NIST Chemistry Reference]

Diethyl-2-thiourea(105-55-5)
[EPA Substance Registry System]

N,N'-Diethylthiourea (105-55-5)
Hazard InformationBack Directory
[Chemical Properties]

white to buff-coloured solid
[Definition]

ChEBI: Thiourea in which each nitogen carries an ethyl substituent.
[General Description]

Buff solid or white powder.
[Reactivity Profile]

N,N'-DIETHYLTHIOUREA(105-55-5) is an amide. Amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx).
[Air & Water Reactions]

This material may be sensitive to exposure to air. . Slightly soluble in water.
[Health Hazard]

ACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes.
[Fire Hazard]

Flash point data are not available for this chemical, but N,N'-DIETHYLTHIOUREA is probably combustible.
[Description]

Diethylthiourea, a thiourea derivative, is used mainly as a rubber chemical, particularly in solid neoprene products.
[Uses]

Diethyl thiourea is the inhibitor of corrosion in metal pick/ing solutions; accelerator for mercaptan-modified chloroprene rubber; antidegradant for natural, nitrile-butadiene, styrene-butadiene, and chloroprene rubbers
[Flammability and Explosibility]

Nonflammable
[Purification Methods]

Crystallise it from *benzene. [Beilstein 4 H 118, 4 I 355, 4 II 610, 4 III 220, 4 IV 375.]
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Exclamation Mark (GHS07)Health Hazard (GHS08)
GHS05,GHS07,GHS08
[Signal word ]

Danger
[Hazard statements ]

H302+H312-H317-H318-H351-H412
[Precautionary statements ]

P273-P280-P301+P312-P302+P352+P312-P305+P351+P338-P308+P313
[Hazard Codes ]

Xn,T
[Risk Statements ]

R22:Harmful if swallowed.
R40:Limited evidence of a carcinogenic effect.
R45:May cause cancer.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
S53:Avoid exposure-obtain special instruction before use .
[WGK Germany ]

2
[RTECS ]

YS9800000
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29309070
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Oral
Aquatic Chronic 3
Carc. 2
Eye Dam. 1
Skin Sens. 1B
[Safety Profile]

Poison by ingestion. Moderately toxic by intraperitoneal route. Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx and SOx
[Hazardous Substances Data]

105-55-5(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Carbon disulfide-->Carbamothioic acid, N-ethyl-, O-ethyl ester-->Ethyl isothiocyanate-->Ethylamine-->Carbamimidothioic acid
[Preparation Products]

Thiourea, N-ethyl-N'-methyl--->1-Ethyl-3-phenyl-2-thiourea-->Hydantoin
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1,3-Diethyl-2-thiourea(105-55-5).msds
Spectrum DetailBack Directory
[Spectrum Detail]

N,N'-Diethylthiourea(105-55-5)MS
N,N'-Diethylthiourea(105-55-5)1HNMR
N,N'-Diethylthiourea(105-55-5)13CNMR
N,N'-Diethylthiourea(105-55-5)IR1
N,N'-Diethylthiourea(105-55-5)IR2
N,N'-Diethylthiourea(105-55-5)IR3
N,N'-Diethylthiourea(105-55-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1,3-Diethyl-2-thiourea(105-55-5)
[Alfa Aesar]

N,N'-Diethylthiourea, 98%(105-55-5)
[Sigma Aldrich]

105-55-5(sigmaaldrich)
[TCI AMERICA]

1,3-Diethyl-2-thiourea,>97.0%(T)(105-55-5)
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