AG01EAA5

Name: 2-(3-methoxy-3-oxopropyl)benzoic acid
Brand: Angene Chemical
SKU: AG01EAA5

33779-03-2 | 2-(3-methoxy-3-oxopropyl)benzoic acid

AG01EAA5

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CAS Number	33779-03-2
Catalog Number	AG01EAA5(AGN-PC-0R9AJO)
Chemical Name	2-(3-methoxy-3-oxopropyl)benzoic acid
IUPAC Name	2-(3-methoxy-3-oxopropyl)benzoic acid
InChI	InChI=1S/C11H12O4/c1-15-10(12)7-6-8-4-2-3-5-9(8)11(13)14/h2-5H,6-7H2,1H3,(H,13,14)
InChI Key	MNTPADVVQJCTIF-UHFFFAOYSA-N
MDL Number	MFCD24479607
Molecular Formula	C11H12O4
Molecular Weight	208.2106
SMILES	COC(CCC1=C(C(O)=O)C=CC=C1)=O
Synonyms	33779-03-2, 2-(3-methoxy-3-oxopropyl)benzoic acid, 2-(2-methoxycarbonylethyl)benzoic Acid, SCHEMBL4243105, Methyl 2-carboxybenzenepropanoate, MNTPADVVQJCTIF-UHFFFAOYSA-N, ZINC36438807, methyl 3-(2-carboxyphenyl)propionate, AKOS005216813, 2-[2-(Methoxycarbonyl)ethyl]benzoic acid, Z2692095121, CID11790422,

Complexity	237
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.074g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	208.213g/mol
Monoisotopic Mass	208.074g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	63.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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