2-Thio-8-(N-heptylthio)theophylline

Base Information

Chemical Name:2-Thio-8-(N-heptylthio)theophylline
CAS No.:4776-10-7
Molecular Formula:C14H22N4OS2
Molecular Weight:326.48
Hs Code.:
NSC Number:95908
UNII:CL48BPE2YN
DSSTox Substance ID:DTXSID00963929
Nikkaji Number:J17.375D
Wikidata:Q82945831
Mol file:4776-10-7.mol

Synonyms:Theophylline, 8-heptylthio-2-thio-;CL48BPE2YN;2-Thio-8-(N-heptylthio)theophylline;4776-10-7;Theophylline, (8-heptylthio)-2-thio-;NSC-95908;Theophylline, 8-(heptylthio)-2-thio-;8-(Heptylthio)-1,2,3,9-tetrahydro-1,3-dimethyl-2-thioxo-6H-purin-6-one;2-Thio-8-n-heptylthiotheophylline;NSC95908;NSC 95908;BRN 1145299;UNII-CL48BPE2YN;Uric acid, 1,3-dimethyl-8-heptylthio-2-thio-;DTXSID00963929;Uric acid,3-dimethyl-(8-heptylthio)-2-thio-;6H-PURIN-6-ONE, 8-(HEPTYLTHIO)-1,2,3,9-TETRAHYDRO-1,3-DIMETHYL-2-THIOXO-;8-(Heptylsulfanyl)-1,3-dimethyl-2-sulfanylidene-1,2,3,9-tetrahydro-6H-purin-6-one

Suppliers and Price of 2-Thio-8-(N-heptylthio)theophylline

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 5 raw suppliers

Chemical Property of 2-Thio-8-(N-heptylthio)theophylline

Chemical Property:

Vapor Pressure:2.11E-10mmHg at 25°C
Boiling Point:507°C at 760 mmHg
Flash Point:260.4°C
PSA：113.00000
Density:1.29g/cm³
LogP:3.39210
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:326.12350369
Heavy Atom Count:21
Complexity:393

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCSC1=NC2=C(N1)C(=O)N(C(=S)N2C)C

Technology Process of 2-Thio-8-(N-heptylthio)theophylline

There total 1 articles about 2-Thio-8-(N-heptylthio)theophylline which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: