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933474-39-6

933474-39-6 | 1-Boc-6-benzyloxyindole

CAS No: 933474-39-6 Catalog No: AG00GTDU MDL No:MFCD09801032

Product Description

Catalog Number:
AG00GTDU
Chemical Name:
1-Boc-6-benzyloxyindole
CAS Number:
933474-39-6
Molecular Formula:
C20H21NO3
Molecular Weight:
323.3856
MDL Number:
MFCD09801032
IUPAC Name:
tert-butyl 6-phenylmethoxyindole-1-carboxylate
InChI:
InChI=1S/C20H21NO3/c1-20(2,3)24-19(22)21-12-11-16-9-10-17(13-18(16)21)23-14-15-7-5-4-6-8-15/h4-13H,14H2,1-3H3
InChI Key:
SRPBCFXYURDQFS-UHFFFAOYSA-N
SMILES:
O=C(n1ccc2c1cc(OCc1ccccc1)cc2)OC(C)(C)C

Properties

Complexity:
425  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.152g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.392g/mol
Monoisotopic Mass:
323.152g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

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