Home Carboxys tert-butyl 6-(iodomethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate

tert-butyl 6-(iodomethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate

CAS No.:
1638771-46-6
Catalog Number:
AG01B51V
Molecular Formula:
C12H20INO3
Molecular Weight:
353.1966
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Product Description
Catalog Number:
AG01B51V
Chemical Name:
tert-butyl 6-(iodomethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate
CAS Number:
1638771-46-6
Molecular Formula:
C12H20INO3
Molecular Weight:
353.1966
MDL Number:
MFCD27986993
IUPAC Name:
tert-butyl 6-(iodomethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate
InChI:
InChI=1S/C12H20INO3/c1-11(2,3)17-10(15)14-7-12(8-14)5-4-9(6-13)16-12/h9H,4-8H2,1-3H3
InChI Key:
LYGQZEWJUKSMPU-UHFFFAOYSA-N
SMILES:
ICC1CCC2(O1)CN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.049g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
353.2g/mol
Monoisotopic Mass:
353.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties