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1-(4-bromophenyl)cyclopropane-1-carbonitrile - 97%, high purity , CAS No.124276-67-1

COA

Grade & Purity:

≥97%

Cas Number: 124276-67-1
Molecular Weight: 222.085
PubChem CID: 2795273
PubChem SID: 488194004

In stock

Item Number

B172872

Grouped product items
SKU	Size	Availability	Price
B172872-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$947.90
B172872-1g	1g	4	$16.90
B172872-250mg	250mg	4	$9.90
B172872-25g	25g	1	$263.90
B172872-5g	5g	1	$58.90

Basic Description

Synonyms	1-(4-Bromophenyl)Cyclopropanecarbonitrile \| 124276-67-1 \| 1-(4-bromophenyl)cyclopropane-1-carbonitrile \| CYCLOPROPANECARBONITRILE, 1-(4-BROMOPHENYL)- \| 1-(4-Bromo-phenyl)-cyclopropanecarbonitrile \| MFCD01314308 \| 1-(4-BROMOPHENYL)CYCLOPROPANECARBONITRILE, 97 \| 1-(4-Bro
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

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	Bromobenzenes
Alternative Parents	Aryl bromides Nitriles Organopnictogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Bromobenzene - Aryl halide - Aryl bromide - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom 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	488194004
IUPAC Name	1-(4-bromophenyl)cyclopropane-1-carbonitrile
INCHI	InChI=1S/C10H8BrN/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4H,5-6H2
InChIKey	BWPZBXQENXGRQV-UHFFFAOYSA-N
Smiles	C1CC1(C#N)C2=CC=C(C=C2)Br
Isomeric SMILES	C1CC1(C#N)C2=CC=C(C=C2)Br
Molecular Weight	222.085
Reaxy-Rn	7369358
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7369358&ln=

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

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

Analytical Chart:

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8 results found

Lot Number	Certificate Type	Date	Item
C2322083	Certificate of Analysis	Mar 27, 2023	B172872
C2322096	Certificate of Analysis	Mar 27, 2023	B172872
C2322092	Certificate of Analysis	Mar 25, 2023	B172872
C2322091	Certificate of Analysis	Mar 25, 2023	B172872
C2322086	Certificate of Analysis	Mar 25, 2023	B172872
C2322088	Certificate of Analysis	Mar 25, 2023	B172872
C2322090	Certificate of Analysis	Mar 25, 2023	B172872
C2322082	Certificate of Analysis	Mar 25, 2023	B172872

Chemical and Physical Properties

Molecular Weight	222.080 g/mol
XLogP3	2.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	220.984 Da
Monoisotopic Mass	220.984 Da
Topological Polar Surface Area	23.800 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	215.000
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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