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Home > Indoles and Oxindole > 885270-03-1
885270-03-1 | tert-Butyl indolin-4-ylcarbamate
CAS No: 885270-03-1 Catalog No: AG00480X MDL No:MFCD08234593
Product Description
Catalog Number:
AG00480X
Chemical Name:
tert-Butyl indolin-4-ylcarbamate
CAS Number:
885270-03-1
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
MDL Number:
MFCD08234593
IUPAC Name:
tert-butyl N-(2,3-dihydro-1H-indol-4-yl)carbamate
InChI:
InChI=1S/C13H18N2O2/c1-13(2,3)17-12(16)15-11-6-4-5-10-9(11)7-8-14-10/h4-6,14H,7-8H2,1-3H3,(H,15,16)
InChI Key:
CLYLKFUWTCPZBF-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc2c1CCN2)OC(C)(C)C
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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