AG002YBO

2942-40-7 | 1H-Indazole, 4-nitro-

AG002YBO

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CAS Number	2942-40-7
Catalog Number	AG002YBO(AGN-PC-0JKDUO)
Chemical Name	1H-Indazole, 4-nitro-
IUPAC Name	4-nitro-1H-indazole
InChI	InChI=1S/C7H5N3O2/c11-10(12)7-3-1-2-6-5(7)4-8-9-6/h1-4H,(H,8,9)
InChI Key	WBTVZVUYPVQEIF-UHFFFAOYSA-N
MDL Number	MFCD00022784
Molecular Formula	C7H5N3O2
Molecular Weight	163.1335
NSC Number	96892
SMILES	O=N(=O)c2cccc1[nH]ncc12
Synonyms	4-Nitro-1H-indazole, 2942-40-7, 4-Nitroindazole, 1H-Indazole, 4-nitro-, INDAZOLE, 4-NITRO-, NSC 96892, BRN 0008161, MLS002703355, CHEMBL393456, WBTVZVUYPVQEIF-UHFFFAOYSA-N, 4nitroindazole, 4-nitro indazole, NSC96892, 4-nitro-1H-indazol, 4-nitro 1H-indazole, PubChem11107, 4-nitro-1 H-indazole, ACMC-1CGLP, 4-Nitro-1H-indazole #, AC1L2B9N, NCIOpen2_001613, WLN: T56 BMNJ FNW, 5-23-06-00179 (Beilstein Handbook Reference), KSC203K0H, SCHEMBL166086, CTK1A3503, DTXSID70183637, HID1013, 1H-Indazole, 4-nitro- (8CI), ZINC169194, BCP26691, CS-D0097, EBD54551, ANW-26621, BDBM50304143, CN-600, MFCD00022784, NSC-96892, SBB066702, AKOS005070452, AKOS015966074, AC-7079, ACN-048446, AN-9341, BCP9000167, MCULE-6302029760, PB32089, RP09012, RTC-066362, TRA0064361, VI20043, KS-0000017J, 1H-Indazole, 4-nitro- (8CI)(9CI), AJ-17083, AK-27888, BC217370, BR-27888, CJ-02441, LS-81533, SC-27364, SMR001570077, SY003894, ZB009049, AB0000620, AB1001788, ST1100627, TC-066362, A5491, AM20040117, FT-0619236, W5196, MFCD00022784 (95%), 42N407, 4P-009, C-8082, A819913, I10-0263, J-515859, Z1741785958, InChI=1/C7H5N3O2/c11-10(12)7-3-1-2-6-5(7)4-8-9-6/h1-4H,(H,8,9, null, C7H5N3O2, C7-H5-N3-O2, CID18057,

Complexity	192
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.038g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	163.136g/mol
Monoisotopic Mass	163.038g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	74.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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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