AG000Z2C

129295-33-6 | 1H-Indazole-3-carboxylic acid, 5,6-difluoro-

AG000Z2C

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CAS Number	129295-33-6
Catalog Number	AG000Z2C(AGN-PC-0NB4YT)
Chemical Name	1H-Indazole-3-carboxylic acid, 5,6-difluoro-
IUPAC Name	5,6-difluoro-1H-indazole-3-carboxylic acid
InChI	InChI=1S/C8H4F2N2O2/c9-4-1-3-6(2-5(4)10)11-12-7(3)8(13)14/h1-2H,(H,11,12)(H,13,14)
InChI Key	NKVHNRMDLDYXKZ-UHFFFAOYSA-N
MDL Number	MFCD05663995
Molecular Formula	C8H4F2N2O2
Molecular Weight	198.1264
SMILES	O=C(C1=NNC2=C1C=C(F)C(F)=C2)O
Synonyms	5,6-difluoro-1H-indazole-3-carboxylic Acid, 129295-33-6, 1H-Indazole-3-carboxylic acid, 5,6-difluoro-, SCHEMBL4785188, CTK4B6231, DTXSID50445346, ZINC2547961, 5482AA, ANW-64004, CD-217, FCH850127, MFCD05663995, AKOS006293711, AB22153, AC-28272, AJ-39466, AK-57188, AN-32435, AS-49401, SC-42098, 5,6-Difluoro-1H-indazole-3-carboxylicacid, AX8027392, DB-062683, RT-009998, ST2418552, 4CH-012754, AM20120438, FT-0710568, A-7176, 295D336, 5,6-bis(fluoranyl)-1H-indazole-3-carboxylic acid, A805924, S14-2869, C8H4F2N2O2, CID10821777,

Complexity	252
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.024g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	198.129g/mol
Monoisotopic Mass	198.024g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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