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Home > Other Heterocycles > 1308648-58-9
1308648-58-9 | tert-butyl N-({9-hydroxy-3-azabicyclo[3.3.1]nonan-1-yl}methyl)carbamate
CAS No: 1308648-58-9 Catalog No: AG019RNS MDL No:MFCD18089622
Product Description
Catalog Number:
AG019RNS
Chemical Name:
tert-butyl N-({9-hydroxy-3-azabicyclo[3.3.1]nonan-1-yl}methyl)carbamate
CAS Number:
1308648-58-9
Molecular Formula:
C14H26N2O3
Molecular Weight:
270.3678
MDL Number:
MFCD18089622
IUPAC Name:
tert-butyl N-[(9-hydroxy-3-azabicyclo[3.3.1]nonan-1-yl)methyl]carbamate
InChI:
InChI=1S/C14H26N2O3/c1-13(2,3)19-12(18)16-9-14-6-4-5-10(11(14)17)7-15-8-14/h10-11,15,17H,4-9H2,1-3H3,(H,16,18)
InChI Key:
RYJJSLPOFQBCMD-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCC12CCCC(C2O)CNC1
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.194g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
270.373g/mol
Monoisotopic Mass:
270.194g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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