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1255574-67-4 | Spiro[2H-indole-2,3'-pyrrolidine]-1'-carboxylic acid, 1,3-dihydro-, 1,1-dimethylethyl ester
CAS No: 1255574-67-4 Catalog No: AG000NV3 MDL No:MFCD17214281
Product Description
Catalog Number:
AG000NV3
Chemical Name:
Spiro[2H-indole-2,3'-pyrrolidine]-1'-carboxylic acid, 1,3-dihydro-, 1,1-dimethylethyl ester
CAS Number:
1255574-67-4
Molecular Formula:
C16H22N2O2
Molecular Weight:
274.3581
MDL Number:
MFCD17214281
IUPAC Name:
tert-butyl spiro[1,3-dihydroindole-2,3'-pyrrolidine]-1'-carboxylate
InChI:
InChI=1S/C16H22N2O2/c1-15(2,3)20-14(19)18-9-8-16(11-18)10-12-6-4-5-7-13(12)17-16/h4-7,17H,8-11H2,1-3H3
InChI Key:
WOICJXSOFFVKPZ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(C1)Cc1c(N2)cccc1)OC(C)(C)C
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.168g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.364g/mol
Monoisotopic Mass:
274.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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