AG01A4KY

Name: 3,4-diethylbenzoic acid
Brand: Angene Chemical
SKU: AG01A4KY

186253-12-3 | 3,4-diethylbenzoic acid

AG01A4KY

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WARNING This product is not for human or veterinary use.

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CAS Number	186253-12-3
Catalog Number	AG01A4KY(AGN-PC-02P4Q4)
Chemical Name	3,4-diethylbenzoic acid
IUPAC Name	3,4-diethylbenzoic acid
InChI	InChI=1S/C11H14O2/c1-3-8-5-6-10(11(12)13)7-9(8)4-2/h5-7H,3-4H2,1-2H3,(H,12,13)
InChI Key	FIUWNZQAIGJKSK-UHFFFAOYSA-N
MDL Number	MFCD20644292
Molecular Formula	C11H14O2
Molecular Weight	178.2277
SMILES	CCC1=C(CC)C=C(C(O)=O)C=C1
Synonyms	3,4-diethylbenzoic acid, 186253-12-3, 3,4-diethyl-benzoic acid, SCHEMBL2755400, ZINC59556820, AKOS017531565, MCULE-3109056542, NE55429, DA-43430, FT-0720462, Z1587257464,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.099g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	178.231g/mol
Monoisotopic Mass	178.099g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

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