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Home > Indoles and Oxindole > 21987-24-6
21987-24-6 | 5-(benzyloxy)-3-methyl-1H-indole
CAS No: 21987-24-6 Catalog No: AG01BIBP MDL No:MFCD22051639
Product Description
Catalog Number:
AG01BIBP
Chemical Name:
5-(benzyloxy)-3-methyl-1H-indole
CAS Number:
21987-24-6
Molecular Formula:
C16H15NO
Molecular Weight:
237.2964
MDL Number:
MFCD22051639
IUPAC Name:
3-methyl-5-phenylmethoxy-1H-indole
InChI:
InChI=1S/C16H15NO/c1-12-10-17-16-8-7-14(9-15(12)16)18-11-13-5-3-2-4-6-13/h2-10,17H,11H2,1H3
InChI Key:
YSAFCQXCCPCUDY-UHFFFAOYSA-N
SMILES:
Cc1c[nH]c2c1cc(OCc1ccccc1)cc2
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.115g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.302g/mol
Monoisotopic Mass:
237.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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