AG003HZV

22174-29-4 | 3-(2,4-Dimethoxyphenyl)propanoic acid

AG003HZV

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CAS Number	22174-29-4
Catalog Number	AG003HZV(AGN-PC-0L1C0G)
Chemical Name	3-(2,4-Dimethoxyphenyl)propanoic acid
IUPAC Name	3-(2,4-dimethoxyphenyl)propanoic acid
InChI	InChI=1S/C11H14O4/c1-14-9-5-3-8(4-6-11(12)13)10(7-9)15-2/h3,5,7H,4,6H2,1-2H3,(H,12,13)
InChI Key	NVDCWSFMCUWKAL-UHFFFAOYSA-N
MDL Number	MFCD00598205
Molecular Formula	C11H14O4
Molecular Weight	210.2265
SMILES	O=C(O)CCC1=CC=C(OC)C=C1OC
Synonyms	3-(2,4-dimethoxyphenyl)propanoic Acid, 22174-29-4, 3-(2,4-Dimethoxyphenyl)propionic acid, Benzenepropanoic acid, 2,4-dimethoxy-, Benzenepropanoic acid,2,4-dimethoxy-, MFCD00598205, ACMC-20anm2, AC1MZC5M, AC1Q4CHG, SCHEMBL490637, CTK4E8828, DTXSID00397629, ZINC404922, ALBB-029465, 2,4-Dimethoxy-benzenepropanoic acid, STL302114, AKOS000193324, MCULE-3747805063, 3-(2,4-dimethoxyphenyl) propionic acid, AJ-22427, L356, TC-066426, FT-0654763, ST50411426, 3-(2,4-Dimethoxyphenyl)propionic acid, 97%, A815993, I14-5180, J-014565, F9995-0943, 3- propionicacid, C11H14O4, CID3870215,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.089g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	210.229g/mol
Monoisotopic Mass	210.089g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

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