AG002VGL

28478-46-8 | Benzoic acid, 4-hydroxy-2-methoxy-, methyl ester

AG002VGL

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CAS Number	28478-46-8
Catalog Number	AG002VGL(AGN-PC-0NJB08)
Chemical Name	Benzoic acid, 4-hydroxy-2-methoxy-, methyl ester
IUPAC Name	methyl 4-hydroxy-2-methoxybenzoate
InChI	InChI=1S/C9H10O4/c1-12-8-5-6(10)3-4-7(8)9(11)13-2/h3-5,10H,1-2H3
InChI Key	KCWJRQPHPPKPBK-UHFFFAOYSA-N
MDL Number	MFCD06203815
Molecular Formula	C9H10O4
Molecular Weight	182.1733
SMILES	COC(=O)C1=CC=C(O)C=C1OC
Synonyms	Methyl 4-hydroxy-2-methoxybenzoate, 28478-46-8, 4-Hydroxy-2-methoxy-benzoic acid methyl ester, 4-HYDROXY-2-METHOXY-BENZOICACIDMETHYLESTER, Benzoic acid, 4-hydroxy-2-methoxy-, methyl ester, 4-hydroxy-2-methoxybenzoic acid methyl ester, Benzoic acid,4-hydroxy-2-methoxy-, methyl ester, SCHEMBL322895, CHEMBL2252250, CTK4G1567, DTXSID70501559, KCWJRQPHPPKPBK-UHFFFAOYSA-N, Methyl 2-methoxy-4-hydroxybenzoate, KS-00000O4W, methyl 4-hydroxy-2-methoxy-benzoate, ANW-59596, MFCD06203815, ZINC13481433, AKOS006294725, MCULE-6292151886, NE22592, VZ29162, AJ-63908, AK-46436, BC224013, DA-17830, DS-13874, SC-95621, TC-069563, CS-0042916, FT-0746246, M90123, Z1837073456, Methyl4-hydroxy-2-methoxybenzoate,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.058g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	182.175g/mol
Monoisotopic Mass	182.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number