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Home › Product Catalog › Alpha,Alpha,Alpha-Trifluoro-m-toluic acid

Alpha,Alpha,Alpha-Trifluoro-m-toluic acid

CAS 454-92-2C8H5F3O2MW 190.12

Alpha,Alpha,Alpha-Trifluoro-m-toluic acid (CAS No. 454-92-2) is supplied by Jinan Shenghe Chemical Co., Ltd. with a typical purity of 按批次COA提供(不公开发布). Main applications include Organic Chemicals. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.

Product Overview

CAS Number454-92-2
Molecular FormulaC8H5F3O2
Molecular Weight190.12
LogP2.95
Purity按批次COA提供(不公开发布)
Packaging按订单/批次确认(不公开发布)
ApplicationsOrganic Chemicals
CategoryOrganic Chemicals

Applications

Organic Chemicals

Packaging & Storage

Packaging按订单/批次确认(不公开发布)
Purity按批次COA提供(不公开发布)
StorageSealed, cool and dry place
ShippingStandard chemical transport
SampleAvailable on request
Lead TimeIn stock / per order

Quality & Documentation

COA (Certificate of Analysis) is provided with every batch. MSDS/technical data sheets and third-party test reports are available on request. Purity and packaging are subject to batch COA and order confirmation.

Frequently Asked Questions

What is the CAS number of Alpha,Alpha,Alpha-Trifluoro-m-toluic acid?

The CAS number of Alpha,Alpha,Alpha-Trifluoro-m-toluic acid is 454-92-2.

What purity and packaging are available?

Typical purity is 按批次COA提供(不公开发布), supplied in 按订单/批次确认(不公开发布), with COA provided.

What are the applications of Alpha,Alpha,Alpha-Trifluoro-m-toluic acid?

Main applications include Organic Chemicals.

How do I buy Alpha,Alpha,Alpha-Trifluoro-m-toluic acid or get a quote?

Email info@591daili.com or reach us on WhatsApp with the product name, CAS number and required quantity; quotes within one business day. Supplier: Jinan Shenghe Chemical Co., Ltd..

PubChem Public Data

Description

Alpha,Alpha,Alpha-Trifluoro-m-toluic acid · CAS 454-92-2 · C8H5F3O2. UNII 930H336M90. LogP: 2.95; Ionization Efficiency: 1.16; Ionization Efficiency: 10.5.

Identification

CAS Registry Number454-92-2
PubChem CID9963
Molecular formulaC8H5F3O2
IUPAC name3-(trifluoromethyl)benzoic acid
UNII (FDA)930H336M90

Computed Descriptors

Molecular Weight190.12
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass190.02416388
Monoisotopic Mass190.02416388
Topological Polar Surface Area37.3
Heavy Atom Count13
Formal Charge0

Physical & Chemical Properties

LogP2.95
Ionization Efficiency1.16
Ionization Efficiency10.5
Ionization EfficiencyMeCN (80%)

Physical description & handling notes

  • Negative
  • Agilent XCT
  • Electrospray ionization
  • ammonia (10nM)
  • DOI:10.1021/acs.analchem.7b00595
  • 132.4 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID2041460]

GHS Hazard Classification

Reported hazard statementsH315 (100%), H319 (100%), H335 (97.9%)

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

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

Documented Uses

  • Benzoic acid, 3-(trifluoromethyl)-: ACTIVE

Synonyms

3-(Trifluoromethyl)benzoic acid; 454-92-2; Benzoic acid, 3-(trifluoromethyl)-; 3-TRIFLUOROMETHYLBENZOIC ACID; alpha,alpha,alpha-Trifluoro-m-toluic acid; m-(Trifluoromethyl)benzoic acid; 3-Trifluoromethylbenzoate; DTXSID2041460; 3-TFMBA; NSC-43025; 930H336M90; DTXCID0021460; CHEBI:60695; m-Toluic acid, alpha,alpha,alpha-trifluoro-; RefChem:496375; meta-trifluoromethylbenzoate

Frequently Asked Questions

What are the CAS number and molecular formula of Alpha,Alpha,Alpha-Trifluoro-m-toluic acid?

CAS 454-92-2; molecular formula C8H5F3O2; molecular weight — g/mol.

What other names is Alpha,Alpha,Alpha-Trifluoro-m-toluic acid known by?

3-(Trifluoromethyl)benzoic acid, 454-92-2, Benzoic acid, 3-(trifluoromethyl)-, 3-TRIFLUOROMETHYLBENZOIC ACID, alpha,alpha,alpha-Trifluoro-m-toluic acid, m-(Trifluoromethyl)benzoic acid.

Is Alpha,Alpha,Alpha-Trifluoro-m-toluic acid classified as hazardous?

Hazard statements reported: H315, H319, H335.

What are the key physical properties of Alpha,Alpha,Alpha-Trifluoro-m-toluic acid?

LogP: 2.95; Ionization Efficiency: 1.16; Ionization Efficiency: 10.5; Ionization Efficiency: MeCN (80%).

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.

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