4-Benzyloxyindole

CAT: 0024-sc-206843Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-206843Size:1 g

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CAS Number

20289-26-3

Chemical Information

4-(phenylmethoxy)-1H-indole

4-Benzyloxyindole is a member of indoles.

CAS Number	20289-26-3
PubChem CID	88465
IUPAC Name	4-phenylmethoxy-1H-indole
Molecular Formula	C15H13NO
Molecular Weight	223.27
XLogP	3.5
Topological Polar Surface Area	25
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	237

SMILES

C1=CC=C(C=C1)COC2=CC=CC3=C2C=CN3

InChI

InChI=1S/C15H13NO/c1-2-5-12(6-3-1)11-17-15-8-4-7-14-13(15)9-10-16-14/h1-10,16H,11H2

InChIKey

LJFVSIDBFJPKLD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20289-26-3

CID: 88465

Formula: C15H13NO

MW: 223.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	223.27
XLogP3	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	223.099714038
Monoisotopic Mass	223.099714038
Topological Polar Surface Area	25 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	237
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-207097	6-Benzyloxyindole
sc-207002	5-Benzyloxyindole
sc-207161	7-Benzyloxyindole
sc-207002A	5-Benzyloxyindole
sc-280480	5-Benzyloxyindole-3-acetamide
sc-280480A	5-Benzyloxyindole-3-acetamide
sc-281472	6-Benzyloxyindole-3-acetic
sc-280479	5-Benzyloxyindole-3- carboxaldehyde
sc-280479A	5-Benzyloxyindole-3- carboxaldehyde
sc-278453	6-Benzyloxyindole-3-carboxaldehyde

Catalog	Name
MBS6038093-01	4-Benzyloxyindole
232883-01	4-Benzyloxyindole 98+% (HPLC)
262519-01	4-Benzyloxyindole-3-acetonitrile
430463-01	4-Benzyloxyindole-3-carboxaldehyde
262518-01	7-Benzyloxyindole
1215-59-4	5-Benzyloxyindole
430461-01	4-Benzyloxyindole-2-carboxylic acid
TYD-00428-01	6-Benzyloxyindole