AG00FBSQ

Name: 2-Methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid
Brand: Angene Chemical
SKU: AG00FBSQ

667413-76-5 | 2-Methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid

AG00FBSQ

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CAS Number	667413-76-5
Catalog Number	AG00FBSQ(AGN-PC-0WB32O)
Chemical Name	2-Methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid
IUPAC Name	2-methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid
InChI	InChI=1S/C11H13NO5/c1-7-6-8(4-5-9(7)12(15)16)17-11(2,3)10(13)14/h4-6H,1-3H3,(H,13,14)
InChI Key	DFBNIRPZFNMCGB-UHFFFAOYSA-N
MDL Number	MFCD03422270
Molecular Formula	C11H13NO5
Molecular Weight	239.2246
SMILES	[N+](=O)([O-])C1=CC=C(C=C1C)OC(C)(C)C(O)=O
Synonyms	2-methyl-2-(3-methyl-4-nitrophenoxy)propanoic acid, 667413-76-5, AKOS B013917, AC1LTFPW, CTK5C5143, DTXSID90364168, ALBB-000887, ZINC1459502, ZX-AN000878, ZX-CM000906, 7740AE, BBL017300, MFCD03422270, STK443125, AKOS000308687, MCULE-1908031161, AJ-26231, TR-051307, ST50846309, Y-0484, C11H13NO5, CID1531809, 2-methyl-2-(3-methyl-4-nitro-phenoxy)propanoic Acid,

Complexity	310
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.079g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	239.227g/mol
Monoisotopic Mass	239.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	92.4A^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