AG00EFPS

Name: 1-O-Tolylbutane-1,3-dione
Brand: Angene Chemical
SKU: AG00EFPS

56290-54-1 | 1-O-Tolylbutane-1,3-dione

AG00EFPS

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CAS Number	56290-54-1
Catalog Number	AG00EFPS(AGN-PC-000TBU)
Chemical Name	1-O-Tolylbutane-1,3-dione
IUPAC Name	1-(2-methylphenyl)butane-1,3-dione
InChI	InChI=1S/C11H12O2/c1-8-5-3-4-6-10(8)11(13)7-9(2)12/h3-6H,7H2,1-2H3
InChI Key	NMAFBIMJKFWSCI-UHFFFAOYSA-N
MDL Number	MFCD07772937
Molecular Formula	C11H12O2
Molecular Weight	176.2118
SMILES	Cc1ccccc1C(=O)CC(=O)C
Synonyms	56290-54-1, 1-o-Tolylbutane-1,3-dione, 1-O-TOLYL-BUTANE-1,3-DIONE, 1-(2-Methylphenyl)-1,3-butanedione, 1-(O-tolyl)butane-1,3-dione, 1-tolyl-butane-1,3-dione, SCHEMBL8383887, DTXSID00557867, NMAFBIMJKFWSCI-UHFFFAOYSA-N, (2'-methylphenyl)-1,3-butandione, MFCD07772937, ZINC100081835, RP03001, Y9479, 1-(2-METHYLPHENYL)BUTANE-1,3-DIONE, J-503589, C11H12O2,

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.084g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	176.215g/mol
Monoisotopic Mass	176.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	34.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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