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3,5-Bis(trifluoromethyl)benzoyl chloride - 97%, high purity , CAS No.785-56-8

COA

Grade & Purity:

≥97%

Cas Number: 785-56-8
Molecular Weight: 276.56
Beilstein Registry Number: 2593440
EC Number: 212-322-0
MDL number: MFCD00000387
PubChem CID: 101856
PubChem SID: 504756498

In stock

Item Number

B120317

Grouped product items
SKU	Size	Availability	Price
B120317-1g	1g	3	$9.90
B120317-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$13.90
B120317-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$39.90
B120317-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$143.90

View related series

Carbonyl compound (2335) Non heterocyclic fluorine-containing block (1408)

Basic Description

Synonyms	3,5-Bis(trifluoromethyl)benzoyl chloride, 97% \| 3,5-di(Trifluoromethyl)benzoyl chloride \| 3,5-bis-trifluoromethylbenzoylchloride \| 5-(AMINOMETHYL)FLUORESCEINHYDROCHLORIDE \| 3,5-bistrifluoromethyl benzoyl chloride \| EINECS 212-322-0 \| AKOS005259939 \| MFCD0
Specifications & Purity	≥97%
Storage Temp	Argon charged
Shipped In	Normal
Product Description	application： 3,5-Bis(trifluoromethyl)benzoyl chloride was used in the quantitative and selective assay for the measurement of low levels of clonidine in human plasma.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Trifluoromethylbenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Trifluoromethylbenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Trifluoromethylbenzenes
Alternative Parents	Benzoic acids and derivatives Benzoyl derivatives Acyl chlorides Organooxygen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Trifluoromethylbenzene - Benzoic acid or derivatives - Benzoyl - Acyl halide - Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organochloride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504756498
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504756498
IUPAC Name	3,5-bis(trifluoromethyl)benzoyl chloride
INCHI	InChI=1S/C9H3ClF6O/c10-7(17)4-1-5(8(11,12)13)3-6(2-4)9(14,15)16/h1-3H
InChIKey	WAKMMQSMEDJRRI-UHFFFAOYSA-N
Smiles	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)Cl
Isomeric SMILES	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)Cl
WGK Germany	3
Molecular Weight	276.56
Beilstein	2593440
Reaxy-Rn	2593440
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2593440&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
F1603125	Certificate of Analysis	Jul 09, 2025	B120317
D2410114	Certificate of Analysis	Mar 20, 2024	B120317
J2123029	Certificate of Analysis	Jul 10, 2023	B120317
B2420019	Certificate of Analysis	Jul 10, 2023	B120317
J2123026	Certificate of Analysis	Jul 10, 2023	B120317
J2123028	Certificate of Analysis	Jul 10, 2023	B120317
B2225464	Certificate of Analysis	Mar 07, 2022	B120317

Chemical and Physical Properties

Sensitivity	Moisture sensitive.
Refractive Index	1.4332
Flash Point(°F)	161.6 °F
Flash Point(°C)	72°(161°F)
Boil Point(°C)	65-67°C/12mm
Molecular Weight	276.560 g/mol
XLogP3	4.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	1
Exact Mass	275.978 Da
Monoisotopic Mass	275.978 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	275.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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