AG005327

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CAS Number	813-58-1
Catalog Number	AG005327(AGN-PC-0WAJ1D)
Chemical Name	2,2-Diethylbutanoic acid
IUPAC Name	2,2-diethylbutanoic acid
InChI	InChI=1S/C8H16O2/c1-4-8(5-2,6-3)7(9)10/h4-6H2,1-3H3,(H,9,10)
InChI Key	GHXNRYVDXNZXID-UHFFFAOYSA-N
MDL Number	MFCD00053496
Molecular Formula	C8H16O2
Molecular Weight	144.2114
SMILES	CCC(C(O)=O)(CC)CC
Synonyms	2,2-Diethylbutanoic acid, 813-58-1, 2,2-DIETHYLBUTYRIC ACID, Butanoic acid,2,2-diethyl-, Butanoic acid, 2,2-diethyl-, GHXNRYVDXNZXID-UHFFFAOYSA-N, 2,2-diethyl butyric acid, NSC938, Triathylessigsaure, TRIETHYLACETIC ACID, AC1L56XC, NCIOpen2_003535, 2,2-Diethylbutanoic acid #, SCHEMBL173322, CTK5E8728, DTXSID70277141, NSC-938, ZINC4353103, MFCD00053496, NSC407528, AKOS012033538, NSC-407528, RP20935, Z2832012381, 2,2-DIETHYLBUTYRICACID, CID219526,

Complexity	106
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.115g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	144.214g/mol
Monoisotopic Mass	144.115g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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