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Home > Other Heterocycles > 2093105-09-8
2093105-09-8 | tert-butyl N-[(1R,2R,3S,5R)-6,6-dimethylspiro[bicyclo[3.1.1]heptane-2,2'-oxirane]-3-yl]carbamate
CAS No: 2093105-09-8 Catalog No: AG01EK0M MDL No:
Product Description
Catalog Number:
AG01EK0M
Chemical Name:
tert-butyl N-[(1R,2R,3S,5R)-6,6-dimethylspiro[bicyclo[3.1.1]heptane-2,2'-oxirane]-3-yl]carbamate
CAS Number:
2093105-09-8
Molecular Formula:
C15H25NO3
Molecular Weight:
267.3639
IUPAC Name:
tert-butyl N-[(1R,2R,3S,5R)-6,6-dimethylspiro[bicyclo[3.1.1]heptane-2,2'-oxirane]-3-yl]carbamate
InChI:
InChI=1S/C15H25NO3/c1-13(2,3)19-12(17)16-11-7-9-6-10(14(9,4)5)15(11)8-18-15/h9-11H,6-8H2,1-5H3,(H,16,17)/t9-,10-,11+,15-/m1/s1
InChI Key:
NLSDUSQYPVZQDN-YYHMBLRTSA-N
SMILES:
O=C(OC(C)(C)C)N[C@H]1C[C@H]2C[C@@H]([C@@]31CO3)C2(C)C
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
267.183g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.369g/mol
Monoisotopic Mass:
267.183g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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