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Home > Indoles and Oxindole > 170147-76-9
170147-76-9 | N-Boc-5-Hydroxyindoline
CAS No: 170147-76-9 Catalog No: AG003STJ MDL No:MFCD11045242
Product Description
Catalog Number:
AG003STJ
Chemical Name:
N-Boc-5-Hydroxyindoline
CAS Number:
170147-76-9
Molecular Formula:
C13H17NO3
Molecular Weight:
235.2790
MDL Number:
MFCD11045242
IUPAC Name:
tert-butyl 5-hydroxy-2,3-dihydroindole-1-carboxylate
InChI:
InChI=1S/C13H17NO3/c1-13(2,3)17-12(16)14-7-6-9-8-10(15)4-5-11(9)14/h4-5,8,15H,6-7H2,1-3H3
InChI Key:
BKEDNSDALWZCGF-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)CCN2C(=O)OC(C)(C)C
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.121g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.283g/mol
Monoisotopic Mass:
235.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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