2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide

Modify Date: 2025-08-30 01:17:40

2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide Structure
2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide structure
 Common Name 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide
CAS Number 94771-99-0 Molecular Weight 447.89900
Density 1.48g/cm3 Boiling Point N/A
Molecular Formula C18H18ClN7O3S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 1-(4-chlorophenyl)-3-[[2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetyl]amino]thiourea

 Chemical & Physical Properties

Density 1.48g/cm3
Molecular Formula C18H18ClN7O3S
Molecular Weight 447.89900
Exact Mass 447.08800
PSA 157.84000
LogP 3.35310
Index of Refraction 1.688

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XF7463613
CHEMICAL NAME :
2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophenyl)amino) thioxomethyl)hydrazide
CAS REGISTRY NUMBER :
94771-99-0
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H18-Cl-N7-O3-S
MOLECULAR WEIGHT :
447.94

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 23,1133,1984

 Synthetic Route

N/A structure

N/A

CAS#:94771-93-4

4-chlorophenyl isothiocyanate structure

4-chlorophenyl ...

CAS#:2131-55-7

~67%

2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide Structure

2H-Tetrazole-2-...

CAS#:94771-99-0

Literature: Pande, Kalpana; Tandon, Manju; Bhalla, T. N.; Barthwal, J. P. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1984 , vol. 23, # 11 p. 1133 - 1135
3,4-Dimethoxybenzonitrile structure

3,4-Dimethoxybe...

CAS#:2024-83-1

~%

2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide Structure

2H-Tetrazole-2-...

CAS#:94771-99-0

Literature: Pande, Kalpana; Tandon, Manju; Bhalla, T. N.; Barthwal, J. P. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1984 , vol. 23, # 11 p. 1133 - 1135
5-(3,4-dimethoxyphenyl)-2H-tetrazole structure

5-(3,4-dimethox...

CAS#:10493-27-3

~%

2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide Structure

2H-Tetrazole-2-...

CAS#:94771-99-0

Literature: Pande, Kalpana; Tandon, Manju; Bhalla, T. N.; Barthwal, J. P. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1984 , vol. 23, # 11 p. 1133 - 1135
Ethyl 5-(3,4-dimethoxyphenyl)tetrazol-2-yl acetate structure

Ethyl 5-(3,4-di...

CAS#:91759-58-9

~%

2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide Structure

2H-Tetrazole-2-...

CAS#:94771-99-0

Literature: Pande, Kalpana; Tandon, Manju; Bhalla, T. N.; Barthwal, J. P. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1984 , vol. 23, # 11 p. 1133 - 1135
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Chemsrc provides CAS#:94771-99-0 MSDS, density, melting point, boiling point, structure, etc. Its name is 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide>> amp version: 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-chlorophe nyl)amino)thioxomethyl)hydrazide

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