AG00EBBA

Name: 3-Methylmandelic acid
Brand: Angene Chemical
SKU: AG00EBBA

65148-70-1 | 3-Methylmandelic acid

AG00EBBA

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CAS Number	65148-70-1
Catalog Number	AG00EBBA(AGN-PC-0TFLKG)
Chemical Name	3-Methylmandelic acid
IUPAC Name	2-hydroxy-2-(3-methylphenyl)acetic acid
InChI	InChI=1S/C9H10O3/c1-6-3-2-4-7(5-6)8(10)9(11)12/h2-5,8,10H,1H3,(H,11,12)
InChI Key	ASTGXUHKUFFOQX-UHFFFAOYSA-N
MDL Number	MFCD03789128
Molecular Formula	C9H10O3
Molecular Weight	166.1739
NSC Number	126597
SMILES	OC(=O)C(c1cccc(c1)C)O
Synonyms	3-Methylmandelic acid, 65148-70-1, 2-hydroxy-2-(3-methylphenyl)acetic acid, hydroxy(3-methylphenyl)acetic acid, 2-Hydroxy-2-(m-tolyl)acetic acid, hydroxy-m-tolyl-acetic acid, NSC126597, PubChem20970, AC1L5MFI, 3-METHYLMANDELICACID, AC1Q5SS4, SCHEMBL698995, 2-hydroxy-2-m-tolylacetic acid, CHEMBL3546299, CTK5C2259, hydroxy-3-methylphenylacetic acid, KS-00003KFB, DTXSID40298863, 3-methylmandelic acid, AldrichCPR, MFCD03789128, AKOS005266062, FS-1579, NSC-126597, J-509622, J-509650, 3-methylsulfanylbenzoic acid, AR-1J2127, CID277664, 2-Hydroxy-3-methylphenyl-acetic acid, 2-Hydroxy-5-methylphenyl-acetic acid, 6574-98-7,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.063g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	166.176g/mol
Monoisotopic Mass	166.063g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1

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