AG003IO4

4670-10-4 | 3,5-Dimethoxyphenylacetic acid

AG003IO4

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CAS Number	4670-10-4
Catalog Number	AG003IO4(AGN-PC-0JMQ1M)
Chemical Name	3,5-Dimethoxyphenylacetic acid
EC Number	923-817-2
IUPAC Name	2-(3,5-dimethoxyphenyl)acetic acid
InChI	InChI=1S/C10H12O4/c1-13-8-3-7(5-10(11)12)4-9(6-8)14-2/h3-4,6H,5H2,1-2H3,(H,11,12)
InChI Key	FFPAFDDLAGTGPQ-UHFFFAOYSA-N
MDL Number	MFCD00016827
Molecular Formula	C10H12O4
Molecular Weight	196.1999
SMILES	COC1=CC(OC)=CC(CC(O)=O)=C1
Synonyms	3,5-Dimethoxyphenylacetic acid, 4670-10-4, 2-(3,5-dimethoxyphenyl)acetic acid, (3,5-dimethoxyphenyl)acetic acid, benzeneacetic acid, 3,5-dimethoxy-, FFPAFDDLAGTGPQ-UHFFFAOYSA-N, MFCD00016827, AK-61829, 3,5-DIMETHOXYPHENYLACETICACID, AC1L3CJG, SCHEMBL347352, ACMC-2097g5, AC1Q497G, BEN290, 3,5-dimethoxybenzeneacetic acid, 3,5-dimethoxy-phenylacetic acid, 3,5-dimethoxyphenyl acetic acid, CTK3J4944, KS-00000CQE, DTXSID60196918, (3,5-dimethoxy)phenylacetic acid, 3,5-(dimethoxyphenyl)acetic acid, 3,5-Dimethoxy phenyl acetic acid, ZINC395572, (3,5-Dimethoxy-phenyl)acetic acid, BCP15337, ANW-13923, BBL101976, CD-445, EBD211049, SBB006648, STL555773, AKOS006222730, AB01216, AM83178, CS-W002109, MCULE-9920452131, OR18847, RTR-017430, TRA0026689, (3,5-Dimethoxyphenyl)acetic acid, 98%, AJ-21522, AS-15610, BBV-38371514, CC-13603, Q031, SC-21211, SY016141, AX8082755, DB-022085, ST2416058, TR-017430, 4CH-015425, D2950, FT-0604686, ST45255360, C-5372, MFCD00016827 (97+%), 670D104, C-08929, I04-5056, InChI=1/C10H12O4/c1-13-8-3-7(5-10(11)12)4-9(6-8)14-2/h3-4,6H,5H2,1-2H3,(H,11,12, C10H12O4, CID138316, ACN-050271, 3,5-Dimethoxyphenylacetic acid, 98% - 1G 1g,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.074g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	196.202g/mol
Monoisotopic Mass	196.074g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P280a-P304+P340-P405-P501a-P261-P305+P351+P338-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Siginal words

Certificate of Analysis

Lot Number