Shanghai Nianxing Industrial Co., Ltd
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Product Name: Palmitic acid
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Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: Propanoic acid,3-[[(phenylamino)thioxomethyl]thio]-
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Purity: 98.0%
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4094-44-4

4094-44-4 structure

4094-44-4 structure

Name: Propanoic acid,3-[[(phenylamino)thioxomethyl]thio]-
Chemical Name: 3-(phenylcarbamothioylsulfanyl)propanoic acid
CAS Number: 4094-44-4
Molecular Formula: C₁₀H₁₁NO₂S₂
Molecular Weight: 241.33000
Create Date: 2017-02-04 11:09:10
Modify Date: 2025-09-27 21:37:52

Name	3-(phenylcarbamothioylsulfanyl)propanoic acid
Synonyms	3-Phenylthiocarbamoylmercapto-propionsaeure 3-phenylthiocarbamoylsulfanyl-propionic acid Propionic acid,3-mercapto-,dithiocarbanilate 3-(phenylaminothiocarbonylthio)propanoic acid 3-Anilino-thiocarbonylmercapto-propionsaeure

Density	1.403g/cm3
Boiling Point	414.1ºC at 760 mmHg
Molecular Formula	C₁₀H₁₁NO₂S₂
Molecular Weight	241.33000
Flash Point	204.3ºC
Exact Mass	241.02300
PSA	106.72000
LogP	2.66430
Index of Refraction	1.701

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UF5270500

CHEMICAL NAME :: Propionic acid, 3-mercapto-, dithiocarbanilate

CAS REGISTRY NUMBER :: 4094-44-4

BEILSTEIN REFERENCE NO. :: 2115585

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C10-H11-N-O2-S2

MOLECULAR WEIGHT :: 241.34

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 :: 345 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARPMAS Archiv der Pharmazie (Weinheim, Germany) (VCH Pub., Inc., 303 NW 12th Ave., Deerfield Beach, FL 33441) V.51-261, 1835-1923; V.305- 1972- Volume(issue)/page/year: 309,161,1976

HS Code	2930909090

74497-02-2 structure

74497-02-2

~%

4094-44-4 structure

4094-44-4

Literature: Orlinskii Pharmaceutical Chemistry Journal, 1996 , vol. 30, # 5 p. 339 - 339

Precursor 0
DownStream 3
880-84-2 4094-46-6 102-07-8

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%

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