AG000MF9

1245816-09-4 | 4-Methyl-1H-indazolyl-5-boronic acid

AG000MF9

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CAS Number	1245816-09-4
Catalog Number	AG000MF9(AGN-PC-0713BA)
Chemical Name	4-Methyl-1H-indazolyl-5-boronic acid
IUPAC Name	(4-methyl-1H-indazol-5-yl)boronic acid
InChI	InChI=1S/C8H9BN2O2/c1-5-6-4-10-11-8(6)3-2-7(5)9(12)13/h2-4,12-13H,1H3,(H,10,11)
InChI Key	IZIRYCSGUBTOOF-UHFFFAOYSA-N
MDL Number	MFCD12028644
Molecular Formula	C8H9BN2O2
Molecular Weight	175.9803
SMILES	OB(C1=C(C)C2=C(NN=C2)C=C1)O
Synonyms	1245816-09-4, (4-methyl-1H-indazol-5-yl)boronic acid, 4-Methyl-1H-indazol-5-yl-5-boronic acid, 4-Methyl-1H-indazole-5-boronic acid, AK-39581, MFCD12028644, 5-Borono-4-methyl-1H-indazole, SCHEMBL15288440, CTK7I2622, KS-00000OMQ, DTXSID60657256, IZIRYCSGUBTOOF-UHFFFAOYSA-N, BCP23488, ZX-AT000750, ANW-49205, FCH836656, 4-methyl-1H-indazol-5-ylboronic acid, AKOS005258657, ZINC169745706, OR40151, RP09333, SB13617, BR-39581, DS-13657, AB0035293, AX8211669, DB-020972, TC-069150, TC-137950, AM20050484, CS-0006069, FT-0685602, ST24029163, X9598, C-2376, Boronic acid, B-(4-methyl-1H-indazol-5-yl)-, 4-Methyl-1H-indazole-5-boronic acid, AldrichCPR, I04-8327, J-515693, C8H9BN2O2, 4-methyl-1H-indazol-5-yl-5-boronic acid, 95% - 1G 1g,

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.076g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	175.982g/mol
Monoisotopic Mass	176.076g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	69.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number