Products for Research Use Only

6-Benzyloxyindole

CAT: 0926-FB03084-01Size: 10 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-FB03084-01Size:10 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
15903-94-3
MDL Number
MFCD00053554
Smiles
C1=CC=C (C=C1) COC2=CC3=C (C=C2) C=CN3
Molecular Formula
C15H13NO
Molecular Weight
223.27 g/mol
Controlled
No

Chemical Information

6-(benzyloxy)-1H-indole
CAS Number15903-94-3
PubChem CID260804
IUPAC Name6-phenylmethoxy-1H-indole
Molecular FormulaC15H13NO
Molecular Weight223.27
XLogP4.1
Topological Polar Surface Area25
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity237
SMILES
C1=CC=C(C=C1)COC2=CC3=C(C=C2)C=CN3
InChI
InChI=1S/C15H13NO/c1-2-4-12(5-3-1)11-17-14-7-6-13-8-9-16-15(13)10-14/h1-10,16H,11H2
InChIKey
FPMICYBCFBLGOZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-(benzyloxy)-1H-indole
CAS: 15903-94-3
CID: 260804
Formula: C15H13NO
MW: 223.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight223.27
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass223.099714038
Monoisotopic Mass223.099714038
Topological Polar Surface Area25 Ų
Heavy Atom Count17
Formal Charge0
Complexity237
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