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Home > Other Heterocycles > 914780-95-3
914780-95-3 | 1,4-dioxa-10-azadispiro[4.2.4?.2?]tetradecan-11-one
CAS No: 914780-95-3 Catalog No: AG018RSE MDL No:MFCD24566289
Product Description
Catalog Number:
AG018RSE
Chemical Name:
1,4-dioxa-10-azadispiro[4.2.4?.2?]tetradecan-11-one
CAS Number:
914780-95-3
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
MDL Number:
MFCD24566289
IUPAC Name:
9,12-dioxa-3-azadispiro[4.2.48.25]tetradecan-2-one
InChI:
InChI=1S/C11H17NO3/c13-9-7-10(8-12-9)1-3-11(4-2-10)14-5-6-15-11/h1-8H2,(H,12,13)
InChI Key:
NUPNYQFGLIQQGM-UHFFFAOYSA-N
SMILES:
O=C1NCC2(C1)CCC1(CC2)OCCO1
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.261g/mol
Monoisotopic Mass:
211.121g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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