AG004U1B

865887-11-2 | 6-Benzyloxy-1H-indazole-3-carboxylic acid

AG004U1B

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CAS Number	865887-11-2
Catalog Number	AG004U1B(AGN-PC-093R2I)
Chemical Name	6-Benzyloxy-1H-indazole-3-carboxylic acid
IUPAC Name	6-phenylmethoxy-1H-indazole-3-carboxylic acid
InChI	InChI=1S/C15H12N2O3/c18-15(19)14-12-7-6-11(8-13(12)16-17-14)20-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)(H,18,19)
InChI Key	JBPCEKWXGCHLSX-UHFFFAOYSA-N
MDL Number	MFCD06739134
Molecular Formula	C15H12N2O3
Molecular Weight	268.2674
SMILES	O=C(C1=NNC2=C1C=CC(OCC3=CC=CC=C3)=C2)O
Synonyms	6-BENZYLOXY-1H-INDAZOLE-3-CARBOXYLIC ACID, 865887-11-2, 6-(benzyloxy)-1H-indazole-3-carboxylic acid, 6-Benzyloxy-1H-indazole-3-carboxylicacid, AK-26370, 6-phenylmethoxy-1H-indazole-3-carboxylic acid, 1H-Indazole-3-carboxylic acid, 6-(phenylmethoxy)-, SCHEMBL492399, CTK3E7621, KS-00000JWT, DTXSID50680038, 3581AC, ANW-60000, MFCD06739134, ZINC66354513, AKOS016004551, AB28675, CB-3833, RP29553, AC-28263, DS-10810, AJ-116755, AX8026416, DB-076690, RT-010545, 4CH-023929, AM20120433, BB 0260777, FT-0743959, ST24045124, Z-6108, 1H-Indazole-3-carboxylicacid, 6-(phenylmethoxy)-, A841734, J-518274, S14-2383, C15H12N2O3, ACN-044857,

Complexity	344
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	268.085g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	268.272g/mol
Monoisotopic Mass	268.085g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	75.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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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