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1-(1,1-Difluoroethyl)-2-fluorobenzene - 96%, high purity , CAS No.1138445-14-3

COA

Grade & Purity:

≥96%

Cas Number: 1138445-14-3
Molecular Weight: 160.14
PubChem CID: 45790660
PubChem SID: 488201245

In stock

Item Number

D578753

Grouped product items
SKU	Size	Availability	Price
D578753-1g	1g	6	$13.90
D578753-5g	5g	5	$43.90
D578753-25g	25g	5	$180.90

Basic Description

Synonyms	1-(1,1-DIFLUOROETHYL)-2-FLUOROBENZENE \| 1138445-14-3 \| Benzene, 1-(1,1-difluoroethyl)-2-fluoro- \| MFCD11845814 \| SCHEMBL11415516 \| AMY5975 \| CMYVOOREJIMEGA-UHFFFAOYSA-N \| DTXSID201288146 \| AKOS005256132 \| MS-20120 \| SY285489 \| 1-(1,1-difluoroethyl)-2-fluoro-benzene' \| CS-0068800
Specifications & Purity	≥96%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Halobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Fluorobenzenes
Alternative Parents	Aryl fluorides Organofluorides Hydrofluorocarbons Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Fluorobenzene - Aryl halide - Aryl fluoride - Hydrofluorocarbon - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
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	488201245
IUPAC Name	1-(1,1-difluoroethyl)-2-fluorobenzene
INCHI	InChI=1S/C8H7F3/c1-8(10,11)6-4-2-3-5-7(6)9/h2-5H,1H3
InChIKey	CMYVOOREJIMEGA-UHFFFAOYSA-N
Smiles	CC(C1=CC=CC=C1F)(F)F
Isomeric SMILES	CC(C1=CC=CC=C1F)(F)F
Molecular Weight	160.14
Reaxy-Rn	40183897
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=40183897&ln=

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
E23151055	Certificate of Analysis	Mar 28, 2023	D578753
E23151063	Certificate of Analysis	Mar 28, 2023	D578753
E23151054	Certificate of Analysis	Mar 28, 2023	D578753
E23151056	Certificate of Analysis	Mar 28, 2023	D578753
E23151071	Certificate of Analysis	Mar 28, 2023	D578753
E23151074	Certificate of Analysis	Mar 28, 2023	D578753

Chemical and Physical Properties

Molecular Weight	160.140 g/mol
XLogP3	2.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	160.05 Da
Monoisotopic Mass	160.05 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	133.000
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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