AG008Z17

1075-11-2 | 6-Fluoroisoquinoline

AG008Z17

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CAS Number	1075-11-2
Catalog Number	AG008Z17(AGN-PC-03H96V)
Chemical Name	6-Fluoroisoquinoline
IUPAC Name	6-fluoroisoquinoline
InChI	InChI=1S/C9H6FN/c10-9-2-1-8-6-11-4-3-7(8)5-9/h1-6H
InChI Key	ALLJCJZVQMDEHE-UHFFFAOYSA-N
MDL Number	MFCD11226829
Molecular Formula	C9H6FN
Molecular Weight	147.1490
SMILES	FC1=CC2=C(C=NC=C2)C=C1
Synonyms	6-FLUOROISOQUINOLINE, 1075-11-2, 6-Fluoro-isoquinoline, Isoquinoline, 6-fluoro-, MFCD11226829, SCHEMBL1551786, CTK0G2994, DTXSID10619526, ALLJCJZVQMDEHE-UHFFFAOYSA-N, BCP02781, KS-00000OO2, ANW-48801, ZINC66055165, AKOS006237641, CM10586, CS-W019741, MB09677, QC-9376, AK-47714, AM802900, BR-47714, CJ-21249, DS-14448, SC-29287, AB0034655, AJ-115769, DB-021008, TC-137546, 4CH-010364, FT-0746549, ST24024406, X8843, S-4727, Z1741978189, C9H6FN, 6-fluoroisoquinoline, 95% - 1G 1g,

Complexity	138
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	147.048g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	147.152g/mol
Monoisotopic Mass	147.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	12.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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