Tris(phenylthio)methane - CAS 4832-52-4
Catalog: |
BB026519 |
Product Name: |
Tris(phenylthio)methane |
CAS: |
4832-52-4 |
Synonyms: |
bis(phenylsulfanyl)methylsulfanylbenzene |
IUPAC Name: | bis(phenylsulfanyl)methylsulfanylbenzene |
Description: | Tris(phenylthio)methane (CAS# 4832-52-4) is a reactant used in the synthesis of a disaccharide repeating unit (IdoA-GlcN) of heparin and heparan sulfate. |
Molecular Weight: | 340.53 |
Molecular Formula: | C19H16S3 |
Canonical SMILES: | C1=CC=C(C=C1)SC(SC2=CC=CC=C2)SC3=CC=CC=C3 |
InChI: | InChI=1S/C19H16S3/c1-4-10-16(11-5-1)20-19(21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15,19H |
InChI Key: | YOQHDHPBEXTHCP-UHFFFAOYSA-N |
Boiling Point: | 488.1 °C at 760 mmHg |
Melting Point: | 39-41 °C |
Purity: | 95 % |
Density: | 1.26 g/cm3 |
Appearance: | White solid, powder or crystals |
MDL: | MFCD00010396 |
LogP: | 6.64690 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-109609973-B | Preparation method and application of organic sulfide modified carbon nanotube loaded low-content palladium composite material | 20181211 |
WO-2017087659-A1 | Liquid crystal sensor | 20151118 |
US-2020409221-A1 | Liquid crystal sensor | 20151118 |
US-2016018371-A1 | Detection of gas-phase analytes using liquid crystals | 20130313 |
US-2017212088-A1 | Detection of gas-phase analytes using liquid crystals | 20130313 |
Complexity: | 242 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 340.04141403 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 340.04141403 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 75.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 7.1 |
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