4-HYDROXYBENZALDEHYDE THIOSEMI-CARBAZONE

Modify Date: 2025-08-23 19:26:54

4-HYDROXYBENZALDEHYDE THIOSEMI-CARBAZONE Structure
4-HYDROXYBENZALDEHYDE THIOSEMI-CARBAZONE structure
Common Name 4-HYDROXYBENZALDEHYDE THIOSEMI-CARBAZONE
CAS Number 5339-74-2 Molecular Weight 195.24200
Density 1.467g/cm3 Boiling Point 351.2ºC at 760 mmHg
Molecular Formula C8H9N3OS Melting Point N/A
MSDS N/A Flash Point 166.2ºC

 Names

Name [(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.467g/cm3
Boiling Point 351.2ºC at 760 mmHg
Molecular Formula C8H9N3OS
Molecular Weight 195.24200
Flash Point 166.2ºC
Exact Mass 195.04700
PSA 102.73000
LogP 1.65050
Index of Refraction 1.781
InChIKey IKDRFCOUGSBGNI-UHFFFAOYSA-N
SMILES NC(=S)NN=Cc1ccc(O)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CU6825000
CHEMICAL NAME :
Benzaldehyde, p-hydroxy-, thiosemicarbazone
CAS REGISTRY NUMBER :
5339-74-2
BEILSTEIN REFERENCE NO. :
2097419
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C8-H9-N3-O-S
MOLECULAR WEIGHT :
195.26
WISWESSER LINE NOTATION :
ZMYUS&MVR DQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,37,1953
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
4 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPPMAB Journal of Pharmacy and Pharmacology. (Pharmaceutical Soc. of Great Britain, 1 Lambeth High St., London SEI 7JN, UK) V.1- 1949- Volume(issue)/page/year: 2,764,1950
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,52,1954
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
320 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01021

 Safety Information

HS Code 2930909090

 Synthetic Route

~89%

4-HYDROXYBENZALDEHYDE THIOSEMI-CARBAZONE Structure

4-HYDROXYBENZAL...

CAS#:5339-74-2

Literature: Alam, Mohammad Sayed; Liu, Lijun; Lee, Yong-Eok; Lee, Dong-Ung Chemical and Pharmaceutical Bulletin, 2011 , vol. 59, # 5 p. 568 - 573 Title/Abstract Full Text View citing articles Show Details Alam, Mohammad Sayed; Liu, Lijun; Lee, Dong Ung Chemical and Pharmaceutical Bulletin, 2011 , vol. 59, # 11 p. 1413 - 1416

~77%

4-HYDROXYBENZALDEHYDE THIOSEMI-CARBAZONE Structure

4-HYDROXYBENZAL...

CAS#:5339-74-2

Literature: Rajak, Harish; Agarawal, Avantika; Parmar, Poonam; Thakur, Bhupendra Singh; Veerasamy, Ravichandran; Sharma, Prabodh Chander; Kharya, Murli Dhar Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 19 p. 5735 - 5738

~77%

4-HYDROXYBENZALDEHYDE THIOSEMI-CARBAZONE Structure

4-HYDROXYBENZAL...

CAS#:5339-74-2

Literature: Mahmoud Egyptian Journal of Chemistry, 2007 , vol. 50, # 3 p. 287 - 302

~%

4-HYDROXYBENZALDEHYDE THIOSEMI-CARBAZONE Structure

4-HYDROXYBENZAL...

CAS#:5339-74-2

Literature: Puetzer et al. Journal of the American Chemical Society, 1951 , vol. 73, p. 2958

 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%

 Synonyms

p-Hydroxybenzaldehyd-thiosemicarbazon
2-[(4-hydroxyphenyl)methylene]hydrazinecarbothioamine
p-Hydroxybenzaldehyde thiosemicarbazone
2-(4-hydroxybenzylidene)hydrazinecarbothioamide
EINECS 226-273-8
Semicarbazide,1-(p-hydroxybenzylidene)-3-thio
Benzaldehyde,p-hydroxy-,thiosemicarbazone
4-Hydroxy-benzaldehyd-thiosemicarbazon
1-(p-Hydroxybenzylidene)thiosemicarbazide
4-hydroxy-benzaldehyde thiosemicarbazone
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