AG003MZP

874668-62-9 | 6-(Benzyloxy)-1H-indazole

AG003MZP

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CAS Number	874668-62-9
Catalog Number	AG003MZP(AGN-PC-00B3J6)
Chemical Name	6-(Benzyloxy)-1H-indazole
IUPAC Name	6-phenylmethoxy-1H-indazole
InChI	InChI=1S/C14H12N2O/c1-2-4-11(5-3-1)10-17-13-7-6-12-9-15-16-14(12)8-13/h1-9H,10H2,(H,15,16)
InChI Key	PMKBUGNQHOFKQS-UHFFFAOYSA-N
MDL Number	MFCD05664005
Molecular Formula	C14H12N2O
Molecular Weight	224.2579
SMILES	C12=C(NN=C2)C=C(OCC3=CC=CC=C3)C=C1
Synonyms	6-(Benzyloxy)-1H-indazole, 874668-62-9, 6-Benzyloxy-1H-indazole, 1H-Indazole, 6-(phenylmethoxy)-, MFCD05664005, 6-phenylmethoxy-1H-indazole, ACMC-209qnp, 6-Benzyloxy-1H-indazol, 6-Benzyloxy 1H-indazole, SCHEMBL4977897, CTK5F8489, KS-00000DHJ, 1H-Indazole,6-(phenylmethoxy)-, DTXSID10468197, ANW-38819, ZINC16677931, AKOS015898264, AB22182, CB-3883, CS-W003236, MCULE-5450756011, RP05337, TRA0002121, AC-29464, AJ-68979, AS-30229, CJ-15528, SC-28953, SY029360, DB-076964, ST2418865, 4CH-000074, FT-0764391, Y4428, B65984, W-3136, MFCD05664005 (95+%), I10-903, J-518041, Z1333873236, C14H12N2O, CID11535911,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.095g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	224.263g/mol
Monoisotopic Mass	224.095g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

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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