p-Cresol glucuronide

Base Information

Chemical Name:p-Cresol glucuronide
CAS No.:17680-99-8
Molecular Formula:C₁₃H₁₆O₇
Molecular Weight:284.266
Hs Code.:
DSSTox Substance ID:DTXSID40170195
Nikkaji Number:J3.193.991G
Wikidata:Q27160003
Metabolomics Workbench ID:41473
Mol file:17680-99-8.mol

Synonyms:4-cresylglucuronide;p-cresylglucuronide

Suppliers and Price of p-Cresol glucuronide

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

Usbiological
p-Cresol Glucuronide
10mg
$ 460.00

TRC
p-CresolGlucuronide
100mg
$ 1455.00

Medical Isotopes, Inc.
p-CresolGlucuronide
100 mg
$ 2200.00

American Custom Chemicals Corporation
P-TOLYL-BETA-D-GLUCURONIDE 95.00%
250MG
$ 797.38

Total 13 raw suppliers

Chemical Property of p-Cresol glucuronide

Chemical Property:

Vapor Pressure:6.42E-13mmHg at 25°C
Refractive Index:1.633
Boiling Point:549.7 °C at 760 mmHg
Flash Point:211.6 °C
PSA：116.45000
Density:1.524 g/cm³
LogP:-0.73400
Storage Temp.:−20°C
Solubility.:H2O: 50 mg/mL, soluble
XLogP3:0.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:284.08960285
Heavy Atom Count:20
Complexity:340

Purity/Quality:

99% ^*data from raw suppliers

p-Cresol Glucuronide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC1=CC=C(C=C1)OC2C(C(C(C(O2)C(=O)O)O)O)O
Isomeric SMILES:CC1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O
Uses P-TOLYL-BETA-D-GLUCURONIDE is a metabolite of o-Cresol (C781910), which is a compound used as a disinfectant and have also been used as antiseptic in surgery. p-Cresol Glucuronide, is a metabolite of o-Cresol (C781910), which is a compound used as a disinfectant and have also been used as antiseptic in surgery.

Technology Process of p-Cresol glucuronide

There total 7 articles about p-Cresol glucuronide 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:

: 106-44-5
p-cresol

: 2616-64-0
UDP-glucuronic acid

: 17680-99-8
4-Methylphenol glucuronide

Guidance literature:: With rainbow trout liver microsomes; magnesium chloride; In various solvent(s); at 25 ℃; for 24h; pH=7.6;
DOI:10.1007/s001289900955

Reference yield:

: 55325-14-9
O¹-p-tolyl-β-D-glucopyranuronic acid methyl ester

: 17680-99-8
4-Methylphenol glucuronide

Guidance literature:: With barium dihydroxide; water;

Reference yield:

: 106-44-5
p-cresol

: 17680-99-8
4-Methylphenol glucuronide

Guidance literature:: Multi-step reaction with 3 steps

1: mercury (II)-cyanide

2: sodium methylate; methanol

3: barium hydroxide; water

With methanol; barium dihydroxide; water; sodium methylate; mercury(II) cyanide;