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125826-60-0

125826-60-0 | 9-Azabicyclo[4.2.1]non-2-ene-9-carboxylic acid, 2-[(methoxyimino)methyl]-, 1,1-dimethylethyl ester, [1R-[1α,2(Z),6α]]- (9CI)

CAS No: 125826-60-0 Catalog No: AG000OTA MDL No:

Product Description

Catalog Number:
AG000OTA
Chemical Name:
9-Azabicyclo[4.2.1]non-2-ene-9-carboxylic acid, 2-[(methoxyimino)methyl]-, 1,1-dimethylethyl ester, [1R-[1α,2(Z),6α]]- (9CI)
CAS Number:
125826-60-0
IUPAC Name:
tert-butyl (1S,6S)-2-(methoxyiminomethyl)-9-azabicyclo[4.2.1]non-2-ene-9-carboxylate
InChI:
InChI=1S/C15H24N2O3/c1-15(2,3)20-14(18)17-12-7-5-6-11(10-16-19-4)13(17)9-8-12/h6,10,12-13H,5,7-9H2,1-4H3/t12-,13-/m0/s1
InChI Key:
BPYBFVSTYLQWHO-STQMWFEESA-N

Properties

Complexity:
423  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
280.179g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.368g/mol
Monoisotopic Mass:
280.179g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.5  

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