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1000931-58-7,MFCD09863462
Catalog No.:AA0000SU
1000931-58-7 | 1,5-Naphthyridine-1(2H)-carboxylic acid, octahydro-, 1,1-dimethylethyl ester
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250mg
97%
1 week  
$310.00
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1g
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$848.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000SU
Chemical Name:
1,5-Naphthyridine-1(2H)-carboxylic acid, octahydro-, 1,1-dimethylethyl ester
CAS Number:
1000931-58-7
Molecular Formula:
C13H24N2O2
Molecular Weight:
240.3419
MDL Number:
MFCD09863462
IUPAC Name:
tert-butyl 3,4,4a,5,6,7,8,8a-octahydro-2H-1,5-naphthyridine-1-carboxylate
InChI:
InChI=1S/C13H24N2O2/c1-13(2,3)17-12(16)15-9-5-6-10-11(15)7-4-8-14-10/h10-11,14H,4-9H2,1-3H3
InChI Key:
NJASRKUXYJXBNQ-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC2C1CCCN2)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.184g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
240.347g/mol
Monoisotopic Mass:
240.184g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
1000931-58-7 
tert-butyl decahydro-1,5-naphthyridine-1-carboxylate 
DTXSID50655685 
KS-000007FM 
9762AH 
MFCD09863462 
AKOS000176093 
AKOS022489863 
PB25219 
AS-34678 
AB1000645 
CS-0048107 
1-BOC-DECAHYDRO-1,5-NAPHTHYRIDINE 
EN300-51015 
Q-3856 
1,5-Naphthyridine-1(2H)-carboxylic acid, octahydro-, 1,1-dimethylethyl ester 
null 
C13H24N2O2 
ACN-044695 
tert-Butyl octahydro-1,5-naphthyridine-1(2H)-carboxylate 
2-BOC-2,7-DIAZABICYCLO[4.4.0]DECANE 
tert-Butyl 3,4,4a,5,6,7,8,8a-octahydro-2H-1,5-naphthyridine-1-carboxylate 
1-N-BOC-OCTAHYDRO-[1,5]NAPHTHYRIDINE 
AC1Q1N4L 
SCHEMBL2026604 
CTK7G3152 
Literature
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