AG00355O

2150-45-0 | Methyl 2,6-dihydroxybenzoate

AG00355O

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CAS Number	2150-45-0
Catalog Number	AG00355O(AGN-PC-0JS952)
Chemical Name	Methyl 2,6-dihydroxybenzoate
IUPAC Name	methyl 2,6-dihydroxybenzoate
InChI	InChI=1S/C8H8O4/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4,9-10H,1H3
InChI Key	WCQZCKUNZVMBDC-UHFFFAOYSA-N
MDL Number	MFCD00059619
Molecular Formula	C8H8O4
Molecular Weight	168.1467
SMILES	O=C(OC)C1=C(O)C=CC=C1O
Synonyms	Methyl 2,6-dihydroxybenzoate, 2150-45-0, 2,6-Dihydroxybenzoic acid methyl ester, Benzoic acid, 2,6-dihydroxy-, methyl ester, .gamma.-Resorcylic acid, methyl ester, CHEMBL2333586, WCQZCKUNZVMBDC-UHFFFAOYSA-N, Methyl 2,6-dihydroxybenzoate, 97%, AC1LAT8W, ACMC-209fl9, 2-(Methoxycarbonyl)resorcinol, SCHEMBL1519936, methyl (2,6-dihydroxy)benzoate, CTK1A1703, KS-00000OUY, DTXSID40334174, ZINC396094, gamma-Resorcylic Acid Methyl Ester, ANW-24475, BDBM50428397, CM-719, METHYL-2,6-DIHYDROXYBENZOATE, MFCD00059619, SBB053697, 2-(Methoxycarbonyl)benzene-1,3-diol, AKOS015890821, CS-W001154, TRA0069869, VZ34446, 2,6-Dihydroxybenzoic acid, methyl ester, AJ-21593, AK-64730, M647, SY017982, TS-02272, ZB012616, AB0015322, DB-066540, TC-113220, D1461, FT-0610666, ST24047584, ST50331829, MFCD00059619 (98%), 150M450, I01-7885, J-014112, InChI=1/C8H8O4/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4,9-10H,1H, Methyl 3,5-dihydroxybenzoate, C8H8O4, CID519869, 2,6-Dihydroxy-benzoic acid methylester, Methyl 3,5-dihydroxybenzoate, 98% - 1G 1g,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.042g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	168.148g/mol
Monoisotopic Mass	168.042g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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