AG00CBDQ

Name: 1-m-Tolyl-butan-1-one
Brand: Angene Chemical
SKU: AG00CBDQ

21550-12-9 | 1-m-Tolyl-butan-1-one

AG00CBDQ

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CAS Number	21550-12-9
Catalog Number	AG00CBDQ(AGN-PC-0L8VH9)
Chemical Name	1-m-Tolyl-butan-1-one
IUPAC Name	1-(3-methylphenyl)butan-1-one
InChI	InChI=1S/C11H14O/c1-3-5-11(12)10-7-4-6-9(2)8-10/h4,6-8H,3,5H2,1-2H3
InChI Key	HFIOTNXMNPDTLO-UHFFFAOYSA-N
MDL Number	MFCD00027137
Molecular Formula	C11H14O
Molecular Weight	162.2283
SMILES	C1(C=CC=C(C)C=1)C(CCC)=O
Synonyms	1-(3-methylphenyl)butan-1-one, 21550-12-9, m-METHYL BUTYROPHENONE, 3'-Methyl-Butyrophenone, 3'-METHYLBUTYROPHENONE, m-Methylbutyrophenone, 1-m-tolylbutan-1-one, AC1N7MWB, AC1Q2UEJ, AC1Q2UF5, SCHEMBL2027904, CTK4E7110, DTXSID80401753, 1-Butanone,1-(3-methylphenyl)-, 1-Butanone, 1-(3-methylphenyl)-, ZINC2166563, AKOS010015356, MCULE-1778260021, CJ-33321, CID4304992,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.104g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	162.232g/mol
Monoisotopic Mass	162.104g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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