AG003MRO

443-73-2 | 5-Fluoroindole-3-acetic acid

AG003MRO

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CAS Number	443-73-2
Catalog Number	AG003MRO(AGN-PC-0JM23R)
Chemical Name	5-Fluoroindole-3-acetic acid
EC Number	207-138-2
IUPAC Name	2-(5-fluoro-1H-indol-3-yl)acetic acid
InChI	InChI=1S/C10H8FNO2/c11-7-1-2-9-8(4-7)6(5-12-9)3-10(13)14/h1-2,4-5,12H,3H2,(H,13,14)
InChI Key	GWLLOJBOPVNWNF-UHFFFAOYSA-N
MDL Number	MFCD00056921
Molecular Formula	C10H8FNO2
Molecular Weight	193.1744
NSC Number	88616
SMILES	O=C(O)CC1=CNC2=C1C=C(F)C=C2
Synonyms	5-FI-AA, 5-Fluoroindole-3-acetic acid, 5-Fluoroindole-3-acetic acid, 443-73-2, 2-(5-fluoro-1H-indol-3-yl)acetic acid, 5-Fluoro-1H-indole-3-acetic acid, 1h-indole-3-acetic acid, 5-fluoro-, (5-fluoro-1H-indol-3-yl)acetic acid, NSC88616, NSC-88616, EINECS 207-138-2, PubChem7277, AC1Q4NE6, NCIStruc1_000046, NCIStruc2_000019, CHEMBL82870, 5-fluoro-indol-3-acetic acid, AC1L3X53, SCHEMBL2260803, CTK1D6143, (5-fluoro-3-indolyl)acetic acid, DTXSID90196108, GWLLOJBOPVNWNF-UHFFFAOYSA-N, ZINC402910, (5-fluoro-3-indolyl)-acetic acid, ACT02530, KS-00003KC9, NCI88616, 2-(5-fluoroindol-3-yl)acetic acid, 1H-Indole-3-aceticacid, 5-fluoro-, ANW-47079, CCG-36277, CF-636, MFCD00056921, NCGC00013924, SBB066676, AKOS009159085, FS-1256, MCULE-2430731854, RP25232, TRA0063181, VI30285, 5-Fluoroindole-3-acetic acid, >=97%, (5-Fluoro-1H-indol-3-yl)-acetic acid, NCGC00013924-02, NCGC00097033-01, AJ-21901, AN-44898, BR-48990, NCI60_041963, SC-78197, SY012017, DB-051213, TC-135824, FT-0620409, ST24033016, W6324, EN300-70517, MFCD00056921 (97%), F-4800, S-5795, 443F732, I10-0182, Z1259273097, Ambap5962, C10H8FNO2, C10-H8-F-N-O2, CID96750, AR-1C3662, 110964-79-9, 47856-54-2,

Complexity	234
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.054g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	193.177g/mol
Monoisotopic Mass	193.054g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	53.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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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