AG00DTRY

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CAS Number	4528-37-4
Catalog Number	AG00DTRY(AGN-PC-0JN9HO)
Chemical Name	diethylhexanoic acid
IUPAC Name	2,2-diethylhexanoic acid
InChI	InChI=1S/C10H20O2/c1-4-7-8-10(5-2,6-3)9(11)12/h4-8H2,1-3H3,(H,11,12)
InChI Key	IMHQFVGHBDXALM-UHFFFAOYSA-N
MDL Number	MFCD16855706
Molecular Formula	C10H20O2
Molecular Weight	172.2646
NSC Number	467
SMILES	C(C)C(C(=O)O)(CCCC)CC
UNII	98T349YMJT
Synonyms	2,2-DIETHYLHEXANOIC ACID, 4528-37-4, UNII-98T349YMJT, 2,2-diethyl-hexanoic acid, Hexanoic acid,2,2-diethyl-, 98T349YMJT, Hexanoic acid, 2,2-diethyl-, NSC467, AC1Q5RXK, SCHEMBL392507, AC1L56I9, DTXSID7058383, CTK4I8713, NSC-467, ZINC1555540, AKOS012033175, UNII-GI044Q7IJ4 component IMHQFVGHBDXALM-UHFFFAOYSA-N, diethylhexanoicacid, DIETHYLHEXANOIC ACID, AR-1D1386, CID219314, 5433-63-6,

Complexity	137
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.146g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.268g/mol
Monoisotopic Mass	172.146g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

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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