AG008562

103986-22-7 | 6-METHOXYINDOLE-3-ACETIC ACID

AG008562

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CAS Number	103986-22-7
Catalog Number	AG008562(AGN-PC-008LXO)
Chemical Name	6-METHOXYINDOLE-3-ACETIC ACID
IUPAC Name	2-(6-methoxy-1H-indol-3-yl)acetic acid
InChI	InChI=1S/C11H11NO3/c1-15-8-2-3-9-7(4-11(13)14)6-12-10(9)5-8/h2-3,5-6,12H,4H2,1H3,(H,13,14)
InChI Key	FRLCWLTTZFMZJI-UHFFFAOYSA-N
MDL Number	MFCD01548400
Molecular Formula	C11H11NO3
Molecular Weight	205.2099
SMILES	COC1=CC=C2C(CC(O)=O)=CNC2=C1
Synonyms	2-(6-methoxy-1H-indol-3-yl)acetic Acid, 103986-22-7, 6-Methoxyindole-3-acetic acid, 1H-Indole-3-aceticacid, 6-methoxy-, 6-methoxy-1H-Indole-3-acetic acid, 1H-Indole-3-acetic acid, 6-methoxy-, M-3475, ACMC-20a9t5, SCHEMBL8581146, CTK0H2520, KS-00000FGF, BIB6101, DTXSID20465071, 6-Methoxy-1H-indole-3-aceticacid, ZINC9970383, 0932AA, ANW-63639, MFCD01548400, AKOS005258990, VI30334, AJ-59643, AK-78957, DS-20260, AX8109554, DB-059077, RT-010685, ST2409353, 4CH-006894, AK00739051, CS-0038760, FT-0726682, A-7714, M12002, C11H11NO3, CID11413063, 2-(6-Methoxy-1H-indol-3-yl)aceticacid,

Complexity	244
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.074g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	205.213g/mol
Monoisotopic Mass	205.074g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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