AG008995

883531-48-4 | 5-Fluoro-1-methyl-1H-indole-2-carbaldehyde

AG008995

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CAS Number	883531-48-4
Catalog Number	AG008995(AGN-PC-0WB56H)
Chemical Name	5-Fluoro-1-methyl-1H-indole-2-carbaldehyde
IUPAC Name	5-fluoro-1-methylindole-2-carbaldehyde
InChI	InChI=1S/C10H8FNO/c1-12-9(6-13)5-7-4-8(11)2-3-10(7)12/h2-6H,1H3
InChI Key	VNPPQGQRPBIRPW-UHFFFAOYSA-N
MDL Number	MFCD06800750
Molecular Formula	C10H8FNO
Molecular Weight	177.1750
SMILES	O=CC(N1C)=CC2=C1C=CC(F)=C2
Synonyms	5-fluoro-1-methyl-1H-indole-2-carbaldehyde, 883531-48-4, SCHEMBL1335436, CTK5F9668, DTXSID30629561, VNPPQGQRPBIRPW-UHFFFAOYSA-N, ALBB-005150, BB_SC-07734, ZX-AN005091, ZX-CM006839, 1642AF, BBL030681, FCH836824, MFCD06800750, STK501608, ZINC16941663, AKOS000321756, MCULE-1973839914, 5-fluoro-1-methylindole-2-carbaldehyde, AJ-69615, BB0220040, TR-043183, BB 0220040, Y-2550, 5-Fluoro-1-methyl-1H-indole-2-carbaldehyde, AldrichCPR, C10H8FNO,

Complexity	209
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	177.059g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	177.178g/mol
Monoisotopic Mass	177.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	22A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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