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Home > Products > Pharmaceuticals & Life Science > Pharmaceutical Intermediates > 1,4-PHENYLENE DIISOTHIOCYANATE
1,4-PHENYLENE DIISOTHIOCYANATE structure, CAS 4044-65-9

1,4-PHENYLENE DIISOTHIOCYANATE

CAS Number4044-65-9

SynonymsBitoscanate; EINECS 223-741-3; 1,4-Diisothiocyanatobenzene,Bitoscanate,PDITC; p-Phenylene diisothiocyanate; MFCD00004811; Benzene 1,4-Diisothiocyanate; 1,4-Diisothiocyanatobenzene; 1,4-Phenylene Diisothiocyanate

Molecular FormulaC6H4(NCS)2

Molecular Weight192.26

Purity

Density1.2g/cm3

Boiling Point339.4ºC at 760 mmHg

Melting Point129-131 °C(lit.)

Flash Point

Appearancewhite powder

EINECS223-741-3

MSDSChineseEnglish

Symbol6.1

Signal WordWarning

Cat. No.: 2A-1184930 Purity:
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Quality Control of [ 4044-65-9 ] SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number4044-65-9
Catalog No.2A-1184930
Chinese Name对苯二异硫氰酸酯
SynonymsBitoscanate; EINECS 223-741-3; 1,4-Diisothiocyanatobenzene,Bitoscanate,PDITC; p-Phenylene diisothiocyanate; MFCD00004811; Benzene 1,4-Diisothiocyanate; 1,4-Diisothiocyanatobenzene; 1,4-Phenylene Diisothiocyanate
Molecular FormulaC6H4(NCS)2
Molecular Weight192.26
Density1.2g/cm3
Boiling Point339.4ºC at 760 mmHg
Melting Point129-131 °C(lit.)
Appearancewhite powder
Water Solubilitychloroform: clear
Storage ConditionThis product should be sealed and stored in a dry
PackagingII
ApplicationBitoscanate (p-Phenylene diisothiocyanate) is an organic compound used to treat hookworms.
EINECS223-741-3
HTC2930909090
PubChem ID24855647
MDL NumberMFCD00004811
SMILESS=C=Nc1ccc(N=C=S)cc1
InChIInChI=1S/C8H4N2S2/c11-5-9-7-1-2-8(4-3-7)10-6-12/h1-4H
InChI KeyOMWQUXGVXQELIX-UHFFFAOYSA-N
Beilstein/REAXYS2414340
NACRES CodeNA.22
UNSPSC12352200
Hazard Symbols6.1
BioactivityBitoscanate (p-Phenylene diisothiocyanate) is an organic chemical compound used in the treatment of hookworms. Related Catalog Signaling Pathways >> Anti-infection >> Parasite Research Areas >> Infection References [1]. Gaitonde BB, et al. Clinical evaluation of a new anthelmintic; phenylene di-iso thiocyanate (Bitoscanate) in hookworm and roundworm infestation. J Trop Med Hyg. 1969 Oct;72(10):253-8. Chemical & Physical Properties Density 1.2g/cm3 Boiling Point 339.4ºC at 760 mmHg Melting Point 129-131 °C(lit.) Molecular Formula C8H4N2S2 Molecular Weight 192.26100 Flash Point 167.2ºC Exact Mass 191.98200 PSA 88.90000 LogP 3.15520 Vapour Pressure 0.000182mmHg at 25°C Index of Refraction 1.641 InChIKey OMWQUXGVXQELIX-UHFFFAOYSA-N SMILES S=C=Nc1ccc(N=C=S)cc1 Storage condition −20°C Water Solubility chloroform: clear
Use ofBitoscanate (p-Phenylene diisothiocyanate) is an organic chemical compound used in the treatment of hookworms. Properties Articles11 Name 1,4-phenylene diisothiocyanate Synonym More Synonyms p-Phenylene diisothiocyanate Biological Activity Description Bitoscanate (p-Phenylene diisothiocyanate) is an organic chemical compound used in the treatment of hookworms. Related Catalog Signaling Pathways >> Anti-infection >> Parasite Research Areas >> Infection References [1]. Gaitonde BB, et al. Clinical evaluation of a new anthelmintic; phenylene di-iso thiocyanate (Bitoscanate) in hookworm and roundworm infestation. J Trop Med Hyg. 1969 Oct;72(10):253-8. Chemical & Physical Properties Molecular Formula C8H4N2S2 Exact Mass 191.98200 PSA 88.90000 LogP 3.15520 Index of Refraction 1.641 InChIKey OMWQUXGVXQELIX-UHFFFAOYSA-N Water Solubility chloroform: clear
Tax Rebate13.0%
SupervisionNone. MFN tariff: 6.5%. Ordinary tariff: 30.0%
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 2811 International Dangerous Regulations for sea transport: 2811 International Dangerous Regulations for air transport: 2811 14.2 United Nations shipping name European Land Transport Dangerous Regulations: TOXIC SOLID, ORGANIC, N.O.S. (Bitoscanate) IMDG Code: TOXIC SOLID, ORGANIC, N.O.S. (Bitoscanate) International air transport hazard regulations: Toxic solid, organic, n.o.s. (Bitoscanate) 14.3 Transport hazard categories European Land Transport Danger Regulations: 6.1 International Maritime Transport Danger Regulations: 6.1 International Air Transport Danger Regulations: 6.1 14.4 Package group European Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available
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