AG007JJB

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CAS Number	30095-48-8
Catalog Number	AG007JJB(AGN-PC-00NDGG)
Chemical Name	2-Bromo-1-[4-(2-methylpropyl)phenyl]ethan-1-one
IUPAC Name	2-bromo-1-[4-(2-methylpropyl)phenyl]ethanone
InChI	InChI=1S/C12H15BrO/c1-9(2)7-10-3-5-11(6-4-10)12(14)8-13/h3-6,9H,7-8H2,1-2H3
InChI Key	JQUBVKCMLJPLLH-UHFFFAOYSA-N
MDL Number	MFCD09034649
Molecular Formula	C12H15BrO
Molecular Weight	255.1509
SMILES	CC(CC1=CC=C(C(CBr)=O)C=C1)C
Synonyms	30095-48-8, 2-bromo-1-[4-(2-methylpropyl)phenyl]ethan-1-one, 2-bromo-1-(4-isobutylphenyl)ethanone, Ethanone, 2-bromo-1-[4-(2-methylpropyl)phenyl]-, 2-bromo-1-(4-isobutylphenyl)-1-ethanone, AC1Q1P7X, SCHEMBL4818283, CTK1C0627, DTXSID60545967, JQUBVKCMLJPLLH-UHFFFAOYSA-N, ZINC19843004, AKOS000210261, NE39888, FT-0728026, EN300-44889, 2-Bromo-1-(4-isobutylphenyl)ethanone, AldrichCPR,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	254.031g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	255.155g/mol
Monoisotopic Mass	254.031g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

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CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited