AG01AB0N

Name: 1-Phenyloctane-1,3-dione
Brand: Angene Chemical
SKU: AG01AB0N

55846-68-9 | 1-Phenyloctane-1,3-dione

AG01AB0N

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CAS Number	55846-68-9
Catalog Number	AG01AB0N(AGN-PC-0NKX3U)
Chemical Name	1-Phenyloctane-1,3-dione
IUPAC Name	1-phenyloctane-1,3-dione
InChI	InChI=1S/C14H18O2/c1-2-3-5-10-13(15)11-14(16)12-8-6-4-7-9-12/h4,6-9H,2-3,5,10-11H2,1H3
InChI Key	KZMBNCLCSWGJDK-UHFFFAOYSA-N
MDL Number	MFCD11178609
Molecular Formula	C14H18O2
Molecular Weight	218.2915
SMILES	CCCCCC(CC(C1=CC=CC=C1)=O)=O
Synonyms	1-phenyloctane-1,3-dione, 55846-68-9, AC1Q2VMN, 1-Phenyl-1,3-octanedione, 1,3-Octanedione, 1-phenyl-, SCHEMBL4828357, CTK1F5809, DTXSID70578246, ZINC34743757, AKOS008122114, MCULE-9399075405, EN300-70106, Z1250132531,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.131g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	218.296g/mol
Monoisotopic Mass	218.131g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	34.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

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