AG005MRB

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CAS Number	68120-72-9
Catalog Number	AG005MRB(AGN-PC-0KKVVK)
Chemical Name	1-(3,4-Dichloro-phenyl)-pentan-1-one
IUPAC Name	1-(3,4-dichlorophenyl)pentan-1-one
InChI	InChI=1S/C11H12Cl2O/c1-2-3-4-11(14)8-5-6-9(12)10(13)7-8/h5-7H,2-4H2,1H3
InChI Key	DAQIQOIKLVJWKH-UHFFFAOYSA-N
MDL Number	MFCD08445511
Molecular Formula	C11H12Cl2O
Molecular Weight	231.1184
SMILES	CCCCC(C1=CC=C(Cl)C(Cl)=C1)=O
Synonyms	1-(3,4-dichlorophenyl)pentan-1-one, 68120-72-9, 1-(3,4-DICHLORO-PHENYL)-PENTAN-1-ONE, 3',4'-Dichlorovalerophenone, AC1MCNUS, SCHEMBL634330, CTK5C7338, KS-00002ASE, DTXSID20378859, DAQIQOIKLVJWKH-UHFFFAOYSA-N, ZX-AT006174, 9421AH, MFCD08445511, ZINC15020536, AKOS009158483, OR11069, PS-7708, 1-Pentanone, 1-(3,4-dichlorophenyl)-, AJ-66787, AK140442, BBV-27029820, BC217143, ST24037154, C11H12Cl2O, CID2774046, 68329-74-8,

Complexity	194
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	230.027g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	231.116g/mol
Monoisotopic Mass	230.027g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.4

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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