AG00EJ02

58506-24-4 | 2-Methoxy-5-Methylphenylacetic Acid

AG00EJ02

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CAS Number	58506-24-4
Catalog Number	AG00EJ02(AGN-PC-0JOA6U)
Chemical Name	2-Methoxy-5-Methylphenylacetic Acid
IUPAC Name	2-(2-methoxy-5-methylphenyl)acetic acid
InChI	InChI=1S/C10H12O3/c1-7-3-4-9(13-2)8(5-7)6-10(11)12/h3-5H,6H2,1-2H3,(H,11,12)
InChI Key	GHVGGBAEPWMNGB-UHFFFAOYSA-N
MDL Number	MFCD06653293
Molecular Formula	C10H12O3
Molecular Weight	180.2005
NSC Number	30128
SMILES	COC1=C(CC(O)=O)C=C(C)C=C1
Synonyms	58506-24-4, 2-Methoxy-5-methylphenylacetic acid, (2-methoxy-5-methylphenyl)acetic acid, 2-(2-methoxy-5-methylphenyl)acetic acid, (2-Methoxy-5-methyl-phenyl)-acetic acid, 2-methoxy-5-methylbenzeneacetic acid, NSC30128, AC1Q5VHT, AC1L5O3U, AC1Q45D3, SCHEMBL13205866, CTK7A6004, HMS1746E21, ZINC1656247, ANW-66404, BBL020368, MFCD06653293, NSC-30128, SBB010650, STK891979, AKOS000296245, MCULE-2799853217, Benzeneacetic acid, 2-methoxy-5-methyl-, AJ-28879, BAS 12768543, SC-54487, AB0176361, TR-045186, BB 0249012, H2820, ST50321554, EN300-13796, (2-Methoxy-5-methylphenyl)acetic acid, AldrichCPR, aceticacid, 2-(2-methoxyphenyl)acetic acid, 2-Methoxy-5-methylphenylaceticacid, KST-1A7130, AR-1A2463, CID232537, 65060-08-4,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.079g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	180.203g/mol
Monoisotopic Mass	180.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P264-P270-P301+P312+P330-P501
UN Code

Certificate of Analysis

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