Calcipotriol

Name: Calcipotriol
Brand: Vaqora Chemicals
SKU: VQ-021953

About Calcipotriol

Listed under CAS 112965-21-6, Calcipotriol is a high-purity reference standard of Calcipotriol available from Vaqora Chemicals. Its molecular formula is C27H40O3 and its molecular weight is 412.6 g/mol. It is also known as calcipotriene or Calciptriol.

It is supplied as a solid. Store the standard in its sealed vial, protected from light and moisture, and follow the storage condition printed on the COA. Under GHS it is labelled “Danger”, so handle it with suitable PPE and consult the SDS.

Laboratories use this Calcipotriol standard for identity and assay testing, system suitability checks and method validation supporting ANDA and DMF filings. Typical end-use sectors are pharmaceutical manufacturing and academic and industrial research.

Standard pack sizes are 10 mg, 25 mg, 50 mg and 100 mg, and every batch ships with a Certificate of Analysis (COA) and we export worldwide.

Typical applications

Identification & assay
Method development & validation
QC reference material

Industries

Related to Calcipotriol

View every impurity, metabolite and intermediate we list for Calcipotriol.

Calcipotriol impurities

Specifications & identifiers

Chemical identifiers
Product name	Calcipotriol
Catalogue No.	VQ-021953
CAS Number	112965-21-6
IUPAC name	trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Molecular formula	C₂₇H₄₀O₃
Molecular weight	412.6 g/mol
Exact mass	412.2977
Grade	Reference Standard
HSN code	38229090
InChIKey	LWQQLNNNIPYSNX-UROSTWAQSA-N
SMILES	C[C@H](/C=C/[C@H](C1CC1)O)[C@H]2CC[C@@H]\3[C@@]2(CCC/C3=C\C=C/4\C[C@H](C[C@@H](C4=C)O)O)C
PubChem CID	5288783

Physical properties
Physical form	Solid
LogP (XLogP3)	4.3
H-bond donors / acceptors	3 / 3
TPSA	60.7 Å²
Synonyms	calcipotriene, Calciptriol, Calcitrene, MC-903, Calcipotriol anhydrous, PRI-2201, Xamiol, Calcipotriol hydrate, MC 903, Calcipotriol (JAN), (5Z,7E,22E,24S)-24-Cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1alpha,3beta,24-triol, (5Z,7E,22E)-(1S,3R,24S)-26,27-cyclo-9,10-seco-5,7,10(19),22-cholestatetraene-1,3,24-triol

Safety & hazard information (GHS)

Toxic

Harmful / irritant

Health hazard

Signal word: Danger

Hazard statements

H300+H310Fatal if swallowed or in contact with skin
H300Fatal if swallowed
H310Fatal in contact with skin
H311Toxic in contact with skin
H315Causes skin irritation
H317May cause an allergic skin reaction
H319Causes serious eye irritation
H330Fatal if inhaled
H335May cause respiratory irritation
H362May cause harm to breast-fed children
H372Causes damage to organs through prolonged or repeated exposure

Precautionary statements: P203, P260, P261, P262, P263, P264, P264 + P265, P270, P271, P272, P280, P284, P301 + P316, P302 + P352, P304 + P340, P305 + P351 + P338, P316, P318, P319, P320, P321, P330, P332 + P317, P333 + P317

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of Calcipotriol?

The CAS Registry Number of Calcipotriol is 112965-21-6. It is also known as calcipotriene, Calciptriol, Calcitrene.

What is the molecular formula and molecular weight of Calcipotriol?

Calcipotriol has the molecular formula C27H40O3 and a molecular weight of 412.6 g/mol.

What is Calcipotriol used for?

Calcipotriol is supplied as a characterised reference material related to Calcipotriol. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of Calcipotriol can I order?

We supply Calcipotriol in Reference Standard grade, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with Calcipotriol?

Yes. Every lot of Calcipotriol is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can Calcipotriol be shipped internationally?

Yes. Calcipotriol is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.