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API Process Intermediates & Related Compounds

Chlorbutanol Hemihydrate

Reference StandardIn stock

Buy Chlorbutanol Hemihydrate (CAS 6001-64-5) from Zemixal: C8H16Cl6O3, COA and SDS with every lot, worldwide shipping. Catalogue no. ZX-012350.

Pack sizes
Chlorbutanol Hemihydrate chemical structure
CAS number6001-64-5
FormulaC8H16Cl6O3
Molar mass372.9 g/mol
Physical formSolid
InChIKeyWRWLCXJYIMRJIN-UHFFFAOYSA-N
IUPAC namebis(1,1,1-trichloro-2-methylpropan-2-ol);hydrate

About Chlorbutanol Hemihydrate

Chlorbutanol Hemihydrate is part of the Zemixal API Process Intermediates & Related Compounds range. Key data (Reference Standard): CAS 6001-64-5, formula C8H16Cl6O3 and molar mass 372.9 g/mol. It is handled as a solid.

Use cases we see most often

  • API route development
  • Impurity fate & purge studies
  • Analytical method development

Safe handling

It carries the GHS signal word Warning (H302, H315, H319 and H335), so wear gloves and eye protection and work with good ventilation.

Order it in 10 mg, 25 mg, 50 mg, 100 mg and 250 mg packs or ask for a bulk quotation. Every shipment includes a batch certificate of analysis and a 16-section SDS. Add it to your quote list and our team replies with price, lead time and shipping options within one business day.

Reference standards for Chlorobutanol

See every impurity, metabolite and related compound we list for this API.

Chlorobutanol standards

Typical uses

  • API route development
  • Impurity fate & purge studies
  • Analytical method development

Applications

Pharmaceutical Manufacturing and QCResearch Labs and Universities

Specifications and identifiers

Specifications of Chlorbutanol Hemihydrate
Product nameChlorbutanol Hemihydrate
Catalogue numberZX-012350
CAS number6001-64-5
Other CAS numbers116295-73-9, 57-15-8
IUPAC namebis(1,1,1-trichloro-2-methylpropan-2-ol);hydrate
Molecular formulaC8H16Cl6O3
Molar mass372.9 g/mol
Exact mass371.9201
GradeReference Standard
Physical formSolid
H-bond donors / acceptors3 / 3
Topological polar surface area41.5 Ų
InChIKeyWRWLCXJYIMRJIN-UHFFFAOYSA-N
SMILESCC(C)(C(Cl)(Cl)Cl)O.CC(C)(C(Cl)(Cl)Cl)O.O
PubChem CID5284505
Synonyms1,1,1-Trichloro-2-methyl-2-propanol Hemihydrate, 1,1,1-Trichloro-tert-butyl Alcohol Hemihydrate, 2,2,2-Trichloro-1,1-dimethylethanol Hemihydrate, 2-(Trichloromethyl)-2-propanol Hemihydrate, Acetochlorone Hemihydrate, Acetonchloroform Hemihydrate, Acetone Chloroform Hemihydrate, Anhydrous chlorobutanol Hemihydrate, Chlorbutol Hemihydrate, Chloreton Hemihydrate, Chloretone Hemihydrate, Chlorobutanol Hemihydrate

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

GHS07 Irritant or harmful
Irritant or harmful

Signal word Warning

  • H302Harmful if swallowed
  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H335May cause respiratory irritation

Precautionary statements P261, P264, P264 + P265, P270, P271, P280, P301 + P317, P302 + P352, P304 + P340, P305 + P351 + P338, P319, P321, P330, P332 + P317, P337 + P317, P362 + P364, P403 + P233, 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

Pack sizes of Chlorbutanol Hemihydrate
10 mgQuoted on request
25 mgQuoted on request
50 mgQuoted on request
100 mgQuoted on request
250 mgQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about Chlorbutanol Hemihydrate

Which CAS number identifies Chlorbutanol Hemihydrate?
Chlorbutanol Hemihydrate is registered under CAS 6001-64-5. You may also see it listed as 1,1,1-Trichloro-2-methyl-2-propanol Hemihydrate, 1,1,1-Trichloro-tert-butyl Alcohol Hemihydrate, 2,2,2-Trichloro-1,1-dimethylethanol Hemihydrate. Our catalogue number for this item is ZX-012350.
What are the formula and molar mass of Chlorbutanol Hemihydrate?
For Chlorbutanol Hemihydrate, its formula is C8H16Cl6O3 and its molar mass is 372.9 g/mol. InChIKey WRWLCXJYIMRJIN-UHFFFAOYSA-N lets you match it in any structure database.
How is Chlorbutanol Hemihydrate used in pharmaceutical QC?
Chlorbutanol Hemihydrate is a characterised reference material linked to Chlorobutanol. Laboratories use it to identify and quantify this impurity during method development and validation, stability work, batch release testing and regulatory submissions.
What grade and pack sizes are available for Chlorbutanol Hemihydrate?
This listing is Reference Standard grade. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg, 250 mg. Larger quantities and custom packing can be quoted on request.
Which documents come with Chlorbutanol Hemihydrate?
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 Chlorbutanol Hemihydrate to my country?
Yes. Because Chlorbutanol Hemihydrate 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.

Other grades with CAS 6001-64-5

More Chlorobutanol standards

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