Methyl 3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionate
- CAS
- 6386-38-5
- Formula
- C18H28O3
- MW
- 292.4 g/mol
ZX-039948
Metabolites & Degradation Products
(2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone
Reference StandardAvailable on request
(2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone (CAS 2095393-15-8) supplier…
![(2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone chemical structure](/media/structures/zx-JSFCZQSJQXFJDS-QAPCUYQASA-N.svg?v=2)
CAS number2095393-15-8
FormulaC25H23ClN4O4
Molar mass478.9 g/mol
Physical formSolid
HS code38229090
InChIKeyJSFCZQSJQXFJDS-QAPCUYQASA-N
IUPAC name(2-chloro-4-phenoxyphenyl)-[4-[[(3R,6S)-6-(hydroxymethyl)oxan-3-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]methanone
About (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone
(2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone sits in our metabolites & Degradation Products section and ships worldwide from stock or short lead time. Identity at a glance (Reference Standard): CAS 2095393-15-8, formula C25H23ClN4O4 and molar mass 478.9 g/mol. It is handled as a solid.
Typical applications
- Metabolite identification
- Stability-indicating methods
- Impurity profiling
Storage and safety notes
Hazard communication follows GHS (Danger: H317, H319, H371 and H372). Our SDS lists exposure controls and first-aid measures.
Standard pack sizes are 10 mg, 25 mg, 50 mg and 100 mg, and custom quantities are quoted on request. Each lot travels with a certificate of analysis with characterisation data. Send an enquiry through the quote panel and you get a formal offer with Incoterms and delivery time.
Typical uses
- Metabolite identification
- Stability-indicating methods
- Impurity profiling
Applications
Specifications and identifiers
| Product name | (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone |
|---|---|
| Catalogue number | ZX-039949 |
| CAS number | 2095393-15-8 |
| IUPAC name | (2-chloro-4-phenoxyphenyl)-[4-[[(3R,6S)-6-(hydroxymethyl)oxan-3-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]methanone |
| Molecular formula | C25H23ClN4O4 |
| Molar mass | 478.9 g/mol |
| Exact mass | 478.1408 |
| Grade | Reference Standard |
| Physical form | Solid |
| XLogP3 | 4.3 |
| H-bond donors / acceptors | 3 / 7 |
| Topological polar surface area | 109 Ų |
| HS code | 38229090 |
| InChIKey | JSFCZQSJQXFJDS-QAPCUYQASA-N |
| SMILES | C1C[C@H](OC[C@@H]1NC2=NC=NC3=C2C(=CN3)C(=O)C4=C(C=C(C=C4)OC5=CC=CC=C5)Cl)CO |
| PubChem CID | 129045720 |
| Synonyms | ARQ 531, ARQ-531, BTK Inhibitor ARQ 531, Bruton's Tyrosine Kinase Inhibitor ARQ 531, ArQule 531, EX-A2727, US11020398, Compound I-123 |
Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.
Safety and GHS hazards
Signal word Danger
- H317May cause an allergic skin reaction
- H319Causes serious eye irritation
- H371May cause damage to organs
- H372Causes damage to organs through prolonged or repeated exposure
- H400Very toxic to aquatic life
- H410Very toxic to aquatic life with long lasting effects
Precautionary statements P260, P261, P264, P264 + P265, P270, P272, P273, P280, P302 + P352, P305 + P351 + P338, P308 + P316, P319, P321, P333 + P317, P337 + P317, P362 + P364, P391, P405, P501
Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.
Pack sizes
| 10 mg | Quoted on request | |
| 25 mg | Quoted on request | |
| 50 mg | Quoted on request | |
| 100 mg | Quoted on request |
Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.
Questions about (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone
Which CAS number identifies (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone?
(2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone is registered under CAS 2095393-15-8. You may also see it listed as ARQ 531, ARQ-531, BTK Inhibitor ARQ 531. Our catalogue number for this item is ZX-039949.
What are the formula and molar mass of (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone?
For (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone, its formula is C25H23ClN4O4 and its molar mass is 478.9 g/mol. The systematic (IUPAC) name is (2-chloro-4-phenoxyphenyl)-[4-[[(3R,6S)-6-(hydroxymethyl)oxan-3-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]methanone. InChIKey JSFCZQSJQXFJDS-QAPCUYQASA-N lets you match it in any structure database.
What grade and pack sizes are available for (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone?
This listing is Reference Standard grade. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg. Larger quantities and custom packing can be quoted on request.
Which documents come with (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone to my country?
Yes. Because (2-Chloro-4-phenoxyphenyl)(4-(((3R,6S)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methanone is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.
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