AG003MRI

1211595-72-0 | 5-Fluoro-6-methoxy-1H-indole

AG003MRI

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CAS Number	1211595-72-0
Catalog Number	AG003MRI(AGN-PC-0ALRRW)
Chemical Name	5-Fluoro-6-methoxy-1H-indole
IUPAC Name	5-fluoro-6-methoxy-1H-indole
InChI	InChI=1S/C9H8FNO/c1-12-9-5-8-6(2-3-11-8)4-7(9)10/h2-5,11H,1H3
InChI Key	NXXKLZQLVSSDKK-UHFFFAOYSA-N
MDL Number	MFCD11109586
Molecular Formula	C9H8FNO
Molecular Weight	165.1643
SMILES	COC1=CC2=C(C=CN2)C=C1F
Synonyms	5-Fluoro-6-methoxy-1H-indole, 1211595-72-0, AK-88353, 5-Fluoro-6-methoxy 1H-indole, SCHEMBL17429715, CTK4B2224, DTXSID00717121, BCP14803, KS-000001LD, ANW-67344, FCH888697, MFCD11109586, ZINC71864216, AKOS006308173, SB15172, BC600087, DS-18462, PC250008, SC-53085, AB0072342, AJ-118904, AX8226586, TC-156089, 4CH-000038, CS-0036584, ST24044745, W-1789, ACN-027453,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.059g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	165.167g/mol
Monoisotopic Mass	165.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	25A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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