Home Other Building Blocks 1-oxa-7-azaspiro[4.4]nonane, trifluoroacetic acid

1-oxa-7-azaspiro[4.4]nonane, trifluoroacetic acid

CAS No.:
2138064-54-5
Catalog Number:
AG01EJ0F
Molecular Formula:
C9H14F3NO3
Molecular Weight:
241.2076
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Product Description
Catalog Number:
AG01EJ0F
Chemical Name:
1-oxa-7-azaspiro[4.4]nonane, trifluoroacetic acid
CAS Number:
2138064-54-5
Molecular Formula:
C9H14F3NO3
Molecular Weight:
241.2076
MDL Number:
MFCD31629000
IUPAC Name:
1-oxa-7-azaspiro[4.4]nonane;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C7H13NO.C2HF3O2/c1-2-7(9-5-1)3-4-8-6-7;3-2(4,5)1(6)7/h8H,1-6H2;(H,6,7)
InChI Key:
RIZBNRGDMKRKNB-UHFFFAOYSA-N
SMILES:
C1COC2(C1)CCNC2.OC(=O)C(F)(F)F
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.093g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
241.21g/mol
Monoisotopic Mass:
241.093g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties