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7- (Phenylmethoxy) -1H-indazole

CAT: 0013-GTR19254439-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19254439-01Size:200 mg
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Description
7- (Phenylmethoxy) -1H-indazole , with CAS No. 351210-09-8, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 7- (Phenylmethoxy) -1H-indazole provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
351210-09-8
Product Name Alternative
Compound 351210 09 8, Compound 351210098
Purity
97.24% (May vary between batches)
Smiles
C (Oc1cccc2cn[nH]c12) c1ccccc1
Molecular Formula
C14H12N2O
Molecular Weight
224.263
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

7-(Benzyloxy)-1H-indazole
CAS Number351210-09-8
PubChem CID44270532
IUPAC Name7-phenylmethoxy-1H-indazole
Molecular FormulaC14H12N2O
Molecular Weight224.26
XLogP3
Topological Polar Surface Area37.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity240
SMILES
C1=CC=C(C=C1)COC2=CC=CC3=C2NN=C3
InChI
InChI=1S/C14H12N2O/c1-2-5-11(6-3-1)10-17-13-8-4-7-12-9-15-16-14(12)13/h1-9H,10H2,(H,15,16)
InChIKey
KRBMFSBSKPMBKX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-(Benzyloxy)-1H-indazole
CAS: 351210-09-8
CID: 44270532
Formula: C14H12N2O
MW: 224.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.26
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass224.094963011
Monoisotopic Mass224.094963011
Topological Polar Surface Area37.9 Ų
Heavy Atom Count17
Formal Charge0
Complexity240
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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