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105-55-5

105-55-5 structural image
Product Name: N,N'-Diethylthiourea
Formula: C5H12N2S
Synonyms: 1,3-Diethylthiourea;N,N′-Diethylthiourea
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Buff solid or white powder. (NTP, 1992)
Color/Form BUFF SOLID
Boiling Point Decomposes (NTP, 1992)
Melting Point 291 °F (NTP, 1992)
Solubility 1 to 5 mg/mL at 68 °F (NTP, 1992)
Vapor Pressure 0.24 [mmHg]
LogP log Kow= 0.57
Other Experimental Properties Decomposes
Chemical Classes Nitrogen Compounds -> Thiourea Compounds

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08
GHS Hazard Statements H317:Sensitisation, Skin
H318:Serious eye damage/eye irritation
H351:Carcinogenicity
H412:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 132.23 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 132.07211956 g/mol
Monoisotopic Mass 132.07211956 g/mol
Topological Polar Surface Area 56.2 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 64.8
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Buff solid or white powder. (NTP, 1992)