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3,5-Ditrifluoromethylacetophenone

CAS 30071-93-3C10H6F6OMW 256.14

3,5-Ditrifluoromethylacetophenone (CAS 30071-93-3) — formula C10H6F6O, molecular weight 256.14; category organic chemicals.

Product Overview

CAS Number30071-93-3
Molecular FormulaC10H6F6O
Molecular Weight256.14
LogP3.9
CategoryOrganic Chemicals

Technical Profile

What this product is

3,5-Ditrifluoromethylacetophenone is a carbon-based organic compound with CAS registry number 30071-93-3 and molecular formula C10H6F6O (molecular weight 256.14), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 30071-93-3

Its molecular formula C10H6F6O comprises 10 C, 6 H, 6 F, 1 O atoms.

Also known as: 3,5-Ditrifluoromethylacetophenone · 3,5-二三氟甲基苯乙酮

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3,5-Ditrifluoromethylacetophenone?

The CAS registry number of 3,5-Ditrifluoromethylacetophenone is 30071-93-3.

What is the molecular formula and molecular weight of 3,5-Ditrifluoromethylacetophenone?

Molecular formula C10H6F6O, molecular weight 256.14.

What other names is 3,5-Ditrifluoromethylacetophenone known by?

It is also registered under: 3,5-Ditrifluoromethylacetophenone, 3,5-二三氟甲基苯乙酮.

Which category does 3,5-Ditrifluoromethylacetophenone belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 3,5-Ditrifluoromethylacetophenone (CAS 30071-93-3), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number30071-93-3
PubChem CID121616
Molecular formulaC10H6F6O
IUPAC name1-[3,5-bis(trifluoromethyl)phenyl]ethanone
UNII (FDA)Q6HO7HB1FG

Computed descriptors

Molecular Weight256.14
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count1
Exact Mass256.03228378
Monoisotopic Mass256.03228378
Topological Polar Surface Area17.1
Heavy Atom Count17

Documented uses on record

  • 1-[3,5-bis(trifluoromethyl)phenyl]ethanone is a known human metabolite of aprepitant.

Synonyms and trade names

30071-93-3; 3,5-Bis(trifluoromethyl)acetophenone; 1-[3,5-bis(trifluoromethyl)phenyl]ethan-1-one; 1-(3,5-Bis(trifluoromethyl)phenyl)ethan-1-one; Q6HO7HB1FG; 3,5-di(Trifluoromethyl)acetophenone; EINECS 250-023-7; DTXSID90184146; 1-(3,5-DI(TRIFLUOROMETHYL)PHENYL)ETHANONE; RefChem:422881; DTXCID00106637; 250-023-7; 3',5'-Bis(trifluoromethyl)acetophenone; 1-(3,5-bis(trifluoromethyl)phenyl)ethanone; 1-[3,5-Bis(trifluoromethyl)phenyl]ethanone; 1-[3,5-di(trifluoromethyl)phenyl]ethan-1-one

GHS hazard classification

Reported hazard statementsH315 (100%), H319 (100%), H335 (98%)

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

What the public record says

3,5-Ditrifluoromethylacetophenone · CAS 30071-93-3 · C10H6F6O. UNII Q6HO7HB1FG.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 3,5-二三氟甲基苯乙酮

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