AG003QTI

7382-59-4 | Guaiacyl glycero-β-guaiacyl ether

AG003QTI

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CAS Number	7382-59-4
Catalog Number	AG003QTI(AGN-PC-0WAK7S)
Chemical Name	Guaiacyl glycero-β-guaiacyl ether
IUPAC Name	1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propane-1,3-diol
InChI	InChI=1S/C17H20O6/c1-21-13-5-3-4-6-14(13)23-16(10-18)17(20)11-7-8-12(19)15(9-11)22-2/h3-9,16-20H,10H2,1-2H3
InChI Key	PPZSOILKWHVNNS-UHFFFAOYSA-N
MDL Number	MFCD00060144
Molecular Formula	C17H20O6
Molecular Weight	320.3371
SMILES	OC(C1=CC=C(O)C(OC)=C1)C(OC2=CC=CC=C2OC)CO
Synonyms	1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1,3-propanediol, 1-HMPMPP cpd, GGBGE, guaiacylglycerol-beta-guaiacyl ether, guaiacylglycerol-beta-O-4-guaiacyl ether, 7382-59-4, GUAIACYLGLYCEROL-BETA-GUAIACYL ETHER, 1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propane-1,3-diol, GGBGE, GGGE, EROL, Guaiacylglycerol-beta-O-4-guaiacyl ether, 1-(4-Hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)-1,3-propanediol, CHEBI:53650, PPZSOILKWHVNNS-UHFFFAOYSA-N, Guaiacyl glycero-|A-guaiacyl ether, Guaiacyl glycero-beta-guaiacyl ether, 2-Methoxy-4-[1,3-dihydroxy-2-(2-methoxyphenoxy)propyl]phenol, 1-(3-Methoxy-4-hydroxyphenyl)-2-(2-methoxyphenoxy)-1,3-propanediol, 2-(2-Methoxyphenoxy)-3-(3-methoxy-4-hydroxyphenyl)propane-1,3-diol, 1-(4-HYDROXY-3-METHOXY-PHENYL)-2-(2-METHOXY-PHENOXY)-PROPANE-1,3-DIOL, Guaiacylglycerol-B-guaiacyl ether, 1-[4-hydroxy-3-(methyloxy)phenyl]-2-{[2-(methyloxy)phenyl]oxy}propane-1,3-diol, 1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1,3-diol, bmse010041, bmse010042, Epitope ID:116881, AC1O4ZL2, SCHEMBL13499771, Guaiacylglycerol-beta-guaiacylEther, KS-000016GX, MFCD00060144, 1-(4-Hydroxy-3-methoxyphenyl)-1,3-dihydroxy-(2-methoxyphenoxy)-propan, AKOS025404995, AK175019, AS-37826, AB0076421, AX8016727, FT-0636467, G0233, C21422, X-2487, guaiacylglycerol-beta-guaiacyl ether, AldrichCPR, A837938, C-19648, 1-(3-methoxy-4-oxidanyl-phenyl)-2-(2-methoxyphenoxy)propane-1,3-diol, guaiacylglycerol-ss-guaiacyl ether, CID6424189, GG,

Complexity	339
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	320.126g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	320.341g/mol
Monoisotopic Mass	320.126g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	88.4A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H400
Packing Group	Ⅲ
Precautionary statements	P273
UN Code	UN 3077

Certificate of Analysis

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