Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 2,5-Cyclohexadiene-1,4-dione,2,5-bis(phenylthio)-
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Purity: 98.0%
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17058-53-6

17058-53-6 structure

17058-53-6 structure

Name: 2,5-Cyclohexadiene-1,4-dione,2,5-bis(phenylthio)-
Chemical Name: 2,5-bis(phenylsulfanyl)cyclohexa-2,5-diene-1,4-dione
CAS Number: 17058-53-6
Molecular Formula: C₁₈H₁₂O₂S₂
Molecular Weight: 324.41700
Create Date: 2017-03-18 00:40:46
Modify Date: 2023-01-17 10:54:41

Name	2,5-bis(phenylsulfanyl)cyclohexa-2,5-diene-1,4-dione
Synonyms	usaf pd-18

Density	1.36g/cm3
Boiling Point	483.2ºC at 760mmHg
Molecular Formula	C₁₈H₁₂O₂S₂
Molecular Weight	324.41700
Flash Point	209.1ºC
Exact Mass	324.02800
PSA	84.74000
LogP	4.49060
Vapour Pressure	1.71E-09mmHg at 25°C
Index of Refraction	1.708

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DK3675000

CHEMICAL NAME :: p-Benzoquinone, 2,5-bis(phenylthio)-

CAS REGISTRY NUMBER :: 17058-53-6

BEILSTEIN REFERENCE NO. :: 3367850

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C18-H12-O2-S2

MOLECULAR WEIGHT :: 324.42

WISWESSER LINE NOTATION :: L6V DVJ BSR& ESR

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 :: 100 mg/kg

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

MUTATION DATA

TYPE OF TEST :: Morphological transformation

TEST SYSTEM :: Rodent - rat Liver

DOSE/DURATION :: 2 mg/L

REFERENCE :: JNCIAM Journal of the National Cancer Institute. (Washington, DC) V.1-60, 1940-78. For publisher information, see JJIND8. Volume(issue)/page/year: 55,375,1975

HS Code	2930909090

108-98-5 structure

108-98-5

106-51-4 structure

106-51-4

~12%

17058-53-6 structure

17058-53-6

80632-58-2 structure

80632-58-2

Detail

Literature: Tandon, Vishnu K.; Kumar, Sandeep; Mishra, Nripendra N.; Shukla, Praveen K. European Journal of Medicinal Chemistry, 2012 , vol. 56, p. 375 - 386

108-98-5 structure

108-98-5

106-51-4 structure

106-51-4

~%

17058-53-6 structure

17058-53-6

Literature: Dimroth; Kraft; Aichinger Justus Liebigs Annalen der Chemie, 1940 , vol. 545, p. 124,133

108-98-5 structure

108-98-5

~%

17058-53-6 structure

17058-53-6

Literature: Dimroth; Kraft; Aichinger Justus Liebigs Annalen der Chemie, 1940 , vol. 545, p. 124,133

Precursor 2
108-98-5 106-51-4
DownStream 2
80632-58-2 89202-65-3

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%