Home Other Building Blocks OCTAHYDRO-[1,6]NAPHTHYRIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER HYDROCHLO+

OCTAHYDRO-[1,6]NAPHTHYRIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER HYDROCHLO+

CAS No.:
1965309-93-6
Catalog Number:
AG01EJ65
Molecular Formula:
C13H25ClN2O2
Molecular Weight:
276.8028
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Product Description
Catalog Number:
AG01EJ65
Chemical Name:
OCTAHYDRO-[1,6]NAPHTHYRIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER HYDROCHLO+
CAS Number:
1965309-93-6
Molecular Formula:
C13H25ClN2O2
Molecular Weight:
276.8028
MDL Number:
MFCD26954779
IUPAC Name:
tert-butyl 3,4,4a,5,6,7,8,8a-octahydro-2H-1,6-naphthyridine-1-carboxylate;hydrochloride
InChI:
InChI=1S/C13H24N2O2.ClH/c1-13(2,3)17-12(16)15-8-4-5-10-9-14-7-6-11(10)15;/h10-11,14H,4-9H2,1-3H3;1H
InChI Key:
AUZLJQQXMOLXDJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC2C1CCNC2)OC(C)(C)C.Cl
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.16g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
276.805g/mol
Monoisotopic Mass:
276.16g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties