Potassium Di-tert-butylphosphate

Inquiry

Molecular Formula:

C8H18O4PK

Molecular Weight:

248.30

CAS Number:

33494-80-3

Catalog Number:

33494-80-3

Product Information

Molecular Formula:

C8H18O4PK

Molecular Weight:

248.30

Description

Utilized as an intermediate to prepare N-phosphonooxymethyl prodrugs, which increase bioavailability, and to prepare Nasicon-type phosphates (i.e., KTi2(PO4)3) used in fast ion conductors with low thermal expansion ceramics.

Synonyms

potassium;ditert-butyl phosphate; potassium;ditert-butyl phosphate

IUPAC Name

potassium;ditert-butyl phosphate

Canonical SMILES

CC(C)(C)OP(=O)([O-])OC(C)(C)C.[K+]

InChI

InChI=1S/C8H19O4P.K/c1-7(2,3)11-13(9,10)12-8(4,5)6;/h1-6H3,(H,9,10);/q;+1/p-1

InChI Key

ZSWXMOQFFWMZQH-UHFFFAOYSA-M

Melting Point

247-252 °C

Flash Point

Not applicable

Storage

2-8 °C

LogP

3.15520

Safety Information

Hazards

H315 - H319 - H335

Precautionary Statement

P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501

Signal Word

Danger

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

248.05797753 g/mol

Monoisotopic Mass

248.05797753 g/mol

Topological Polar Surface Area

58.6Å²

Heavy Atom Count

Formal Charge

Complexity

196

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
CN-113816992-A	Preparation method of potassium di-tert-butyl phosphate	2021-10-30
CN-113045423-A	High-performance resin based on polymerized rosin group and preparation method and application thereof	2021-03-16
CN-113827736-A	Camptothecin drug with high-stability hydrophilic connecting unit and conjugate thereof	2020-06-08
WO-2021249228-A1	Camptothecin drug having high-stability hydrophilic connecting unit and conjugate thereof	2020-06-08
WO-2021205298-A1	Compounds and methods for the treatment of covid-19	2020-04-05
AU-2021253796-A1	Compounds and methods for the treatment of COVID-19	2020-04-05
CA-3140164-A1	Compounds and methods for the treatment of covid-19	2020-04-05
EP-3953361-A1	Compounds and methods for the treatment of covid-19	2020-04-05
KR-20210151949-A	Compounds and methods for the treatment of COVID-19	2020-04-05
US-2022017548-A1	Compounds and Methods for the Treatment of COVID-19	2020-04-05

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The dilution calculator equation

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