AG007AIG

169674-01-5 | 5,6-Difluoroindole

AG007AIG

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CAS Number	169674-01-5
Catalog Number	AG007AIG(AGN-PC-0KKZ3C)
Chemical Name	5,6-Difluoroindole
IUPAC Name	5,6-difluoro-1H-indole
InChI	InChI=1S/C8H5F2N/c9-6-3-5-1-2-11-8(5)4-7(6)10/h1-4,11H
InChI Key	YCVSNMPGFSFANR-UHFFFAOYSA-N
MDL Number	MFCD01075212
Molecular Formula	C8H5F2N
Molecular Weight	153.1288
SMILES	Fc1cc2c(cc1F)[nH]cc2
Synonyms	5,6-Difluoroindole, 169674-01-5, 5,6-difluoro-1H-indole, 1H-INDOLE, 5,6-DIFLUORO-, MFCD01075212, PubChem1675, AC1MCTXY, 5,6-difluoro-1H-indol, ACMC-1C0PY, SCHEMBL188052, Jsp003460, CHEMBL4087204, CTK0H4789, KS-00000NFN, DTXSID10381099, YCVSNMPGFSFANR-UHFFFAOYSA-N, BH164, ACT02477, ZINC2572572, ANW-22415, BBL100796, CD-471, FC0207, SBB054559, STL554590, AKOS005063978, AC-2258, AS05060, CS-W009079, EF10172, MB01663, PS-6843, QC-9158, RP01774, RTC-061122, VI30033, AJ-42045, AK-26629, AN-14174, BC202341, BR-26629, CJ-09963, N457, SC-01637, AB0015800, AB1005646, DB-006925, ST2411634, TC-061122, TL8001324, 4CH-015434, AM20060362, FT-0080568, FT-0601328, B-7429, D-2520, 674D015, 3S101358, F0001-0620, Z1741971829, 5,6-difluoro-1H-indole; 5,6-difluoro-1H-indole-2-carboxylic acid, 5,6-Difluoro-INDOLE, C8H5F2N, ZINC02572572, CID2778732,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.039g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	153.132g/mol
Monoisotopic Mass	153.039g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	15.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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