AG003IIQ

Name: 3,4-Dimethylcyclohexanone
Brand: Angene Chemical
SKU: AG003IIQ

5465-09-8 | 3,4-Dimethylcyclohexanone

AG003IIQ

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CAS Number	5465-09-8
Catalog Number	AG003IIQ(AGN-PC-0WG3MH)
Chemical Name	3,4-Dimethylcyclohexanone
IUPAC Name	3,4-dimethylcyclohexan-1-one
InChI	InChI=1S/C8H14O/c1-6-3-4-8(9)5-7(6)2/h6-7H,3-5H2,1-2H3
InChI Key	ZDCYWXYPRPCJOY-UHFFFAOYSA-N
MDL Number	MFCD00045552
Molecular Formula	C8H14O
Molecular Weight	126.1962
NSC Number	28978
SMILES	CC1C(C)CC(=O)CC1
Synonyms	3,4-Dimethylcyclohexanone, 5465-09-8, 3,4-dimethylcyclohexan-1-one, 3,4-Dimethyl cyclohexanone, 3,4-Dimethylcyclohexanone,c&t, NSC28978, AC1L3CZJ, ACMC-1CFC3, Cyclohexanone,3,4-dimethyl-, SCHEMBL856067, Cyclohexanone, 3,4-dimethyl-, CTK5A2087, ZDCYWXYPRPCJOY-UHFFFAOYSA-N, 7-(dimethylamino)-6-methylcoumarin, MFCD00045552, NSC-28978, AKOS026729826, NE11015, AS-43460, DB-052623, TC-170000, FT-0635742, 3,4-Dimethylcyclohexanone (mixture of isomers), I14-85708, CID138519, CIS-3,4-DIMETHYLCYCLOHEXANONE, Cyclohexanone, 3,4-dimethyl-, cis-, D1281, 27922-05-0,

Complexity	118
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	126.104g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	126.199g/mol
Monoisotopic Mass	126.104g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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