AG0054YT

78155-76-7 | 5-NITRO-1H-INDAZOLE-3-CARBOXYLIC ACID

AG0054YT

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CAS Number	78155-76-7
Catalog Number	AG0054YT(AGN-PC-0LWYN3)
Chemical Name	5-NITRO-1H-INDAZOLE-3-CARBOXYLIC ACID
IUPAC Name	5-nitro-1H-indazole-3-carboxylic acid
InChI	InChI=1S/C8H5N3O4/c12-8(13)7-5-3-4(11(14)15)1-2-6(5)9-10-7/h1-3H,(H,9,10)(H,12,13)
InChI Key	MLTOGNYOQHDCAN-UHFFFAOYSA-N
MDL Number	MFCD05663993
Molecular Formula	C8H5N3O4
Molecular Weight	207.1430
SMILES	O=C(C1=NNC2=C1C=C([N+]([O-])=O)C=C2)O
Synonyms	5-nitro-1H-indazole-3-carboxylic Acid, 78155-76-7, 5-Nitroindazole-3-carboxylic acid, 1H-INDAZOLE-3-CARBOXYLIC ACID, 5-NITRO-, PubChem11871, SCHEMBL959264, AC1OG877, AC1Q748B, CTK2H6873, DTXSID00428008, MLTOGNYOQHDCAN-UHFFFAOYSA-N, KS-000003RQ, ZINC4237920, ANW-61398, BBL021431, CN-620, MFCD05663993, SBB069487, STK894144, 5-Nitro-1H-indazole-3-carboxylicacid, AKOS005144152, MCULE-8967569948, PB32391, 1H-Indazole-3-carboxylicacid, 5-nitro-, AC-29512, AJ-76849, AK-44426, AS-33721, SY036719, AB0038190, ST1100657, TC-150143, A9851, AM20041171, CS-0050422, FT-0604117, Y5547, EN300-30664, MFCD05663993 (95%), Q-1191, 155N767, S14-0909, Z317046460, C8H5N3O4, Nitro indazole carboxylic acid, 5-Nitroindazole-3-carboxylicacid, CID7144652,

Complexity	290
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.028g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	207.145g/mol
Monoisotopic Mass	207.028g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	112A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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