AG00HZBZ

169674-35-5 | 1H-Indole-2-carboxylicacid, 5,6-difluoro-

AG00HZBZ

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CAS Number	169674-35-5
Catalog Number	AG00HZBZ(AGN-PC-024YSX)
Chemical Name	1H-Indole-2-carboxylicacid, 5,6-difluoro-
IUPAC Name	5,6-difluoro-1H-indole-2-carboxylic acid
InChI	InChI=1S/C9H5F2NO2/c10-5-1-4-2-8(9(13)14)12-7(4)3-6(5)11/h1-3,12H,(H,13,14)
InChI Key	XBVUJSXNSDFADV-UHFFFAOYSA-N
MDL Number	MFCD01863160
Molecular Formula	C9H5F2NO2
Molecular Weight	197.1383
SMILES	O=C(C(N1)=CC2=C1C=C(F)C(F)=C2)O
Synonyms	169674-35-5, 5,6-Difluoroindole-2-carboxylic acid, 5,6-difluoro-1H-indole-2-carboxylic acid, 1H-Indole-2-carboxylicacid, 5,6-difluoro-, Q-103544, 5,6-Difluoroindole-2-CarboxylicAcid, PubChem1677, Intermediates-ZCF02264, ACMC-209e02, SCHEMBL1822934, CTK0H4302, DTXSID90597136, XBVUJSXNSDFADV-UHFFFAOYSA-N, ACT13016, BCP23365, ZINC2386974, ZX-AP008755, ANW-22416, CD-856, CD0126, FCH922468, MFCD01863160, PC3024, SBB066624, AKOS006345773, AC-9835, AS02117, CM13601, GS-6226, RD-0117, RTC-066354, SB15291, VI30036, KS-0000269A, AJ-35412, AK-25483, AN-30906, BC202347, CC-20928, SC-01638, AB0015801, AB1005649, AX8008334, DB-017796, ST2405963, TC-066354, 4CH-001098, AM20030134, FT-0643624, 5,6-difluoroindole-2-carboxylic acid, 98+%, W-4063, 5,6-bis(fluoranyl)-1H-indole-2-carboxylic acid, 674D355, A839069, C-09059, C9H5F2NO2, 5-chloro-6-fluoro-1H-indole, ACN-029344, 5,6-Difluoro-1H-indole-2-carboxylicacid, N458, A3746, 773-64-8,

Complexity	249
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.029g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	197.141g/mol
Monoisotopic Mass	197.029g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	53.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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