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6972-05-0

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6972-05-0 Structure

6972-05-0 Structure
IdentificationBack Directory
[Name]

1,1-Dimethyl-thiourea
[CAS]

6972-05-0
[Synonyms]

Ai3-17358
Nsc 67246
Einecs 230-204-7
1,1-Dimethyl-thiourea
1,1-dimethyl-2-thiourea
Urea, 1,1-dimethyl-2-thio-
Thiourea, N,N-dimethyl- (9ci)
Urea, 1,1-dimethyl-2-thio- (8ci)
[EINECS(EC#)]

230-204-7
[Molecular Formula]

C3H8N2S
[MDL Number]

MFCD00060474
[MOL File]

6972-05-0.mol
[Molecular Weight]

104.17
Chemical PropertiesBack Directory
[Melting point ]

163-164 °C
[Boiling point ]

144.6±23.0 °C(Predicted)
[density ]

1.108±0.06 g/cm3(Predicted)
[pka]

15.52±0.29(Predicted)
[InChI]

InChI=1S/C3H8N2S/c1-5(2)3(4)6/h1-2H3,(H2,4,6)
[InChIKey]

ZQGWBPQBZHMUFG-UHFFFAOYSA-N
[SMILES]

N(C)(C)C(N)=S
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301
[Precautionary statements ]

P501-P270-P264-P301+P310+P330-P405
[HazardClass ]

IRRITANT
[HS Code ]

2930909099
Hazard InformationBack Directory
[Uses]

N,N-dimethylthiourea is used in preparation of sodium gluconate drug intermediate.
Spectrum DetailBack Directory
[Spectrum Detail]

1,1-Dimethyl-thiourea(6972-05-0)1HNMR
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