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Home > Indoles and Oxindole > 914349-25-0
914349-25-0 | 3-Iodo-5-methyl-1H-indole, N-BOC protected
CAS No: 914349-25-0 Catalog No: AG00IGOM MDL No:MFCD05864765
Product Description
Catalog Number:
AG00IGOM
Chemical Name:
3-Iodo-5-methyl-1H-indole, N-BOC protected
CAS Number:
914349-25-0
Molecular Formula:
C14H16INO2
Molecular Weight:
357.1868
MDL Number:
MFCD05864765
IUPAC Name:
tert-butyl 3-iodo-5-methylindole-1-carboxylate
InChI:
InChI=1S/C14H16INO2/c1-9-5-6-12-10(7-9)11(15)8-16(12)13(17)18-14(2,3)4/h5-8H,1-4H3
InChI Key:
MCEHWHPEDUZTAJ-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c(I)cn2C(=O)OC(C)(C)C
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.023g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
357.191g/mol
Monoisotopic Mass:
357.023g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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