Home Other Building Blocks 3-oxa-7-azabicyclo[3.3.1]nonan-9-ol, acetic acid

3-oxa-7-azabicyclo[3.3.1]nonan-9-ol, acetic acid

CAS No.:
1443980-27-5
Catalog Number:
AG01A5PB
Molecular Formula:
C9H17NO4
Molecular Weight:
203.2356
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Product Description
Catalog Number:
AG01A5PB
Chemical Name:
3-oxa-7-azabicyclo[3.3.1]nonan-9-ol, acetic acid
CAS Number:
1443980-27-5
Molecular Formula:
C9H17NO4
Molecular Weight:
203.2356
MDL Number:
MFCD24842999
IUPAC Name:
acetic acid;3-oxa-7-azabicyclo[3.3.1]nonan-9-ol
InChI:
InChI=1S/C7H13NO2.C2H4O2/c9-7-5-1-8-2-6(7)4-10-3-5;1-2(3)4/h5-9H,1-4H2;1H3,(H,3,4)
InChI Key:
SUXJQGKOKDITRI-UHFFFAOYSA-N
SMILES:
OC1C2CNCC1COC2.CC(=O)O
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.116g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
203.238g/mol
Monoisotopic Mass:
203.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties