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Hydrazodicarbothioamid

2,5-Dithiobiurea

HCID 2724564
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Grundinformationen

CAS
142-46-1
Standard-SMILES
NC(=S)NNC(N)=S
InChIKey
KCOYHFNCTWXETP-UHFFFAOYSA-N
Summenformel
C2H6N4S2
Durchschnittliche Molmasse
150,23 g/mol
Monoisotopische Masse
150,00338856

Überblick

2,5-dithiobiurea is a brown powder. (NTP, 1992)

Namen und Bezeichner

Bevorzugter Name
2,5-Dithiobiurea
IUPAC
(carbamothioylamino)thiourea
Lokaler Name
Hydrazodicarbothioamid
Englischer Name
Hydrazodicarbothioamide
Summenformel
C2H6N4S2
Molmasse
150.23

Namen und Synonyme

2,5-DITHIOBIUREA142-46-1HydrazodicarbothioamideDithiobiureaBithioureaDithioureaBis(thiourea)1,2-HydrazinedicarbothioamideDithiocarbamoylhydrazine2,5-DithiodiureaBisthiocarbamyl hydrazineBithiourea (VAN)
Weitere Namen anzeigen
BISTHIOUREAhydrazine-1,2-bis(carbothioaMide)usafb-44usafb-55
USAF ek-p-6281Biurea, 2,5-dithio-Dithiobiurea (VAN)USAF B-44USAF B-55N,N'-Bis(thiocarbamyl)hydrazineNCI-C03009NSC 3511

Datenbank-Bezeichner

CAS
142-46-1
PubChem CID
2724564
DTXSID
DTXSID8020545
ChEMBL
CHEMBL541231
UNII
825972ISQX
EC Number
205-537-6
Nikkaji
J16.830K

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,9
Polarare Oberfläche (TPSA)
140 Ų
H-Brücken-Donoren
4
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
0
Schwere Atome
8
Formalladung
0
Komplexität
96,6

Experimentelle und physikochemische Eigenschaften

Chemical ClassesNitrogen Compounds -> Thiourea Compounds
Solubilityless than 0.1 mg/mL at 73 °F (NTP, 1992)
Physical Description · 2 Einträge

2,5-dithiobiurea is a brown powder. (NTP, 1992)

Brown solid; [CAMEO] Off-white powder; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
212 °C · 212 °C (dec.)(lit.)
Siedepunkt
291.6 · 291.6±23.0 °C(Predicted)
Dichte
1.412 · 1.412 (estimate)
Brechungsindex
1.5605 · 1.5605 (estimate)
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
Aggregatzustand
solid
pka
10.24 · 10.24±0.70(Predicted)
Farbe
White to Light yellow

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (12.8%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Fire HazardsThe flash point of this chemical has not been determined, but it is probably combustible. (NTP, 1992)
Hazards SummaryHas reproductive effects when fed to female pigs; No evidence of mutagenicity; [HSDB] No evidence of carcinogenicity in rats and male mice and equivocal evidence in female mice; [NTP] An irritant; [Alfa Aesar MSDS]
Reactive GroupAzo, Diazo, Azido, Hydrazine, and Azide Compounds
Special ReportsDHEW/NCI; Bioassay of 2,5-Dithiobiurea for Possible Carcinogenicity (1979) Technical Rpt Series No. 132 DHEW Pub No. (NIH) 79-1387
Reactivity Profile · 1 Eintrag

2,5-DITHIOBIUREA is related to dithiocarbamates. Flammable gases are generated by the combination of thiocarbamates and dithiocarbamates with aldehydes, nitrides, and hydrides. Thiocarbamates and dithiocarbamates are incompatible with acids, peroxides, and acid halides.

Air and Water ReactionsInsoluble in water.
Hazard Classes and Categories

Chemie und Industrie

Verwendung und Herstellung

Uses · 2 Einträge

Used in organic synthesis and as a component of photographic chemicals; [NTP]

Photographic Processing [Category: Other]

General Manufacturing Information1,2-Hydrazinedicarbothioamide: ACTIVE
Anwendungen · 1 Eintrag

Verwenden2,5-Dithiobiurea is used in radiopharmaceutical imaging, inhibiting enzyme function, kidney function study and to treat toxic metal poisoning. It is also used in co-crystals development and in the field of nonlinear optics to generate new coherent wavelengths

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

Hydrazinium(2+)-sulfatAmmoniumthiocyanatSulforhodamine

Nachgelagerte Produkte

5-Amino-1,3,4-thiadiazole-2-thiol2-(Acetamido)-5-(chlorosulfonyl)-1,3,4-thiadiazoleBismerthiazol3-Amino-5-mercapto-1,2,4-triazole

Anbieter100 Anbieter

梯希爱(上海)化成工业发展有限公司

Zugehörige Reaktionen

0
Reaktionsaufzeichnung erstellen

Keine Reaktionsaufzeichnungen unter den aktuellen Filterkriterien.

Notizen zur Verbindung

Wird geladen…

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Wasserlöslichkeit
Soluble in hot water, pyridine, triethylamine and dimethylformamide. Insoluble in cold water.
BRN
1723178 · 1723178
InChI
InChI=1S/C2H6N4S2/c3-1(7)5-6-2(4)8/h(H3,3,5,7)(H3,4,6,8)
InChIKey
KCOYHFNCTWXETP-UHFFFAOYSA-N
SMILES
N(C(N)=S)NC(N)=S
CAS Datenbank
142 · 142-46-1(CAS DataBase Reference)
EPA chemische Informationen
2 · 2,5-Dithiobiurea (142-46-1)
Acute Tox. 4 (12.8%)

Sicherheit und Schutzausrüstung

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 Eintrag

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 Eintrag

SMALL SPILLS AND LEAKAGE: If you spill this chemical, you should dampen the solid spill material with water, then transfer the dampened material to a suitable container. Use absorbent paper dampened with water to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Wash all contaminated surfaces with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 Eintrag

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Toxikologische Informationen

Ongoing Test Status · 1 Eintrag

The following link will take the user to the National Toxicology Program (NTP) Test Agent Search Results page, which tabulates all of the "Standard Toxicology & Carcinogenesis Studies", "Developmental Studies", and "Genetic Toxicity Studies" performed with this chemical. Clicking on the "Testing Status" link will take the user to the status (i.e., in review, in progress, in preparation, on test, completed, etc.) and results of all the studies that the NTP has done on this chemical. [http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.searchresults&searchterm=142-46-1]

Human Toxicity Excerpts · 1 Eintrag

In the manufacture of rubber, irritant contact dermatitis may occur from a variety of acids, alkalies, detergents, and solvents used in the process. Allergic contact dermatitis occurs not infrequently and is almost always due to an organic accelerator or antioxidant. While the list of potential sensitizing accelerators and antioxidants is enormous, common allergens include ... thioureas. /Thioureas/

Carcinogen Classification · 6 Einträge

2,5-Dithiobiurea

TR-132: Bioassay of 2,5-Dithiobiurea for Possible Carcinogenicity (CASRN 142-46-1) (1979 )

10/25/78

No Evidence

No Evidence

No Evidence

Non-Human Toxicity Excerpts · 4 Einträge

ADMIN TO MALE & FEMALE MICE IN FEED FOR 78 WK @ CONCN OF 1 & 2%. AMONG FEMALE MICE HIGH INCIDENCE OF HEPATOCELLULAR CARCINOMA, WHILE THERE WAS NO INCREASE IN CARCINOGENICITY IN MALE MICE AND CONTROLS.

INCR WT OF ADRENAL GLANDS & OVARIES IF FED DURING ESTRUS CYCLE TO GILTS. LOWER FOLLICLE STIMULATING HORMONE INDICATED INHIBITION OF SYNTHESIS. RELEASE OF LUTEINIZING HORMONE WAS SUPPRESSED, THIS SUPPRESSION WAS SUPPORTED BY LACK OF OVULATION AND ESTRUS.

ADMIN TO MALE & FEMALE RATS IN FEED FOR 78 WK AT CONCN OF 0.6 OR 1.2%. THERE WAS NO CARCINOGENICITY FOR EITHER MALE OR FEMALE RATS.

2,5-Dithiobiurea was found to be negative when tested for mutagenicity using the Salmonella/microsome preincubation assay, using the standard protocol approved by the National Toxicology Program (NTP). 2,5-Dithiobiurea was tested in as many as 5 Salmonella typhimurium strains (TA1535, TA1537, TA97, TA98, and TA100) in the presence and absence of rat and hamster liver S9, at doses of 0.001, 0.0033, 0.010, 0.033, 0.100, 0.333, and 1.000 mg/plate. The highest ineffective dose tested in any Salmonella typhimurium strain was 1.000 mg/plate.

National Toxicology Program Studies · 1 Eintrag

A bioassay of 2,5-dithiobiurea for possible carcinogenicity was conducted using Fischer 344 rats and B6C3F1 mice. 2,5-Dithiobiurea was administered in the feed, at either of two concentrations, to groups of 50 male and 50 female animals of each species, with the exception of high dose male rats, of which there were only 49. The dietary concentrations used in the chronic bioassay were 0.6% for the low dose rats and 1.2% for the high dose rats. The dietary concentrations used for low and high dose mice were 1.0 and 2.0%, respectively. After a 78 week dosing period, observation of the rats continued for an additional 31 weeks and observation of the mice continued for an additional 16 weeks. For each species, 50 animals of each sex were placed on test as controls. Among female mice, the Cochran-Armitage test indicated a significant positive association between the incidence of hepatocellular carcinoma and dietary concentration of 2,5-dithiobiurea. According to results of the Fisher exact test, the incidence of hepatocellular carcinoma was significantly higher in the high dose female mouse group when compared to the corresponding control group but not when compared to the laboratory historical control data. No neoplasms occurred at a significantly higher incidence in dosed male mice than in their controls. Under the conditions of this bioassay, the evidence suggested, but was insufficient to establish the carcinogenicity of 2,5-dithiobiurea for female B6C3F1 mice. The compound was not carcinogenic to male B6C3F1 mice or to male or female Fischer 344 rats.

Sicherheitsdaten

wgk
3
tsca
TSCA listed
hs_code
2930.90.9250
RTECS-Nr.
EC1460000
risk_code
36/37/38
hazard_code
Xi
safety_code
26-37/39
Giftige Stoffe Daten
142-46-1(Hazardous Substances Data)
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