Carbamimidothioic acid,C,C'-1,3-propanediyl ester, hydrobromide (1:2)

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Names

[ CAS No. ]:
5442-32-0

[ Name ]:
Carbamimidothioic acid,C,C'-1,3-propanediyl ester, hydrobromide (1:2)

[Synonym ]:
1,3-bis-carbamimidoylmercapto-propane,dihydrobromide
1,3-Bis-carbamimidoylmercapto-propan,Dihydrobromid
propanediisothioureadihydrobromide
2,2'-trimethylenebisisothiouronium dibromide
PROPYLENE DIISOTHIURONIUM DIBROMIDE
carbamimidothioicacid,1,3-propanediylester,dihydrobromide

Chemical & Physical Properties

[ Boiling Point ]:
343.8ºC at 760mmHg

[ Molecular Formula ]:
C5H13BrN4S2

[ Molecular Weight ]:
273.21800

[ Flash Point ]:
161.7ºC

[ Exact Mass ]:
271.97700

[ PSA ]:
150.34000

[ LogP ]:
3.18800

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UO1320000
CHEMICAL NAME :
Pseudourea, 2,2'-trimethylenedithiodi-, dihydrobromide
CAS REGISTRY NUMBER :
5442-32-0
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C5-H12-N4-S2.2Br-H
MOLECULAR WEIGHT :
354.17
WISWESSER LINE NOTATION :
MUYZS3SYZUM &EH 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD691-490
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ATMPA2 Annals of Tropical Medicine and Parasitology. (Grune & Stratton, Inc., POB 6280, Duluth, MN 55806) V.1- 1907- Volume(issue)/page/year: 32,177,1938

Safety Information

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1,3-Dibromopropane
  • 3-bromopropyl carbamimidothioate hydrobromide

DownStream

  • 3,7,14,18-Tetrathiatricyclo[18.2.2.29,12]hexacosa-9,10,11,20,22,23-hexaene
  • 2,6-dithia[7]paracyclophane

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%

Related Compounds

  • 3-[5-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-N,3-dimethylpentanamido]-2-methylpropanoic acid
  • rac-methyl 2-[(1R,3R)-3-aminocyclopentyl]acetate
  • 2-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pentanamido]-6-methylbenzoic acid
  • 3-chloro-4-[5-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pentanamido]benzoic acid
  • 1-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylpropanoyl]-octahydro-1H-indole-2-carboxylic acid
  • 2-ethyl-2-{[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanamido]methyl}butanoic acid
  • 1-({[1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclobutyl]formamido}methyl)cyclopropane-1-carboxylic acid
  • 3-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylbutanamido]-2,2-dimethylpropanoic acid
  • (2R)-2-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanamido]-4-(methylsulfanyl)butanoic acid
  • 2-[(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methyl-N-(propan-2-yl)butanamido]acetic acid
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