200,000+ products from a single source!
sales@angenechem.com
125736-12-1 | 9-Azabicyclo[4.2.1]non-2-ene-9-carboxylic acid, 2-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]acetyl]-, 1,1-dimethylethyl ester, (1R,6R)-
CAS No: 125736-12-1 Catalog No: AG000OKX MDL No:
Product Description
Catalog Number:
AG000OKX
Chemical Name:
9-Azabicyclo[4.2.1]non-2-ene-9-carboxylic acid, 2-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]acetyl]-, 1,1-dimethylethyl ester, (1R,6R)-
CAS Number:
125736-12-1
Molecular Formula:
C21H37NO4Si
Molecular Weight:
395.6083
IUPAC Name:
tert-butyl (1R)-2-[2-[tert-butyl(dimethyl)silyl]oxyacetyl]-9-azabicyclo[4.2.1]non-2-ene-9-carboxylate
InChI:
InChI=1S/C21H37NO4Si/c1-20(2,3)26-19(24)22-15-10-9-11-16(17(22)13-12-15)18(23)14-25-27(7,8)21(4,5)6/h11,15,17H,9-10,12-14H2,1-8H3/t15?,17-/m1/s1
InChI Key:
QHGGUUXKQRWOKY-OMOCHNIRSA-N
SMILES:
O=C(C1=CCC[C@H]2N([C@@H]1CC2)C(=O)OC(C)(C)C)CO[Si](C(C)(C)C)(C)C
Properties
Complexity:
613
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
395.249g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
395.615g/mol
Monoisotopic Mass:
395.249g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.