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Home > Indoles and Oxindole > 885270-12-2
885270-12-2 | tert-Butyl indolin-7-ylcarbamate
CAS No: 885270-12-2 Catalog No: AG00486H MDL No:MFCD08234596
Product Description
Catalog Number:
AG00486H
Chemical Name:
tert-Butyl indolin-7-ylcarbamate
CAS Number:
885270-12-2
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
MDL Number:
MFCD08234596
IUPAC Name:
tert-butyl N-(2,3-dihydro-1H-indol-7-yl)carbamate
InChI:
InChI=1S/C13H18N2O2/c1-13(2,3)17-12(16)15-10-6-4-5-9-7-8-14-11(9)10/h4-6,14H,7-8H2,1-3H3,(H,15,16)
InChI Key:
SVLRQBLEXCOLQL-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1cccc2c1NCC2
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.137g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.299g/mol
Monoisotopic Mass:
234.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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