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Home > Other Heterocycles > 1706451-40-2
1706451-40-2 | 6-azaspiro[3.4]octane, oxalic acid
CAS No: 1706451-40-2 Catalog No: AG01BFBF MDL No:MFCD23105788
Product Description
Catalog Number:
AG01BFBF
Chemical Name:
6-azaspiro[3.4]octane, oxalic acid
CAS Number:
1706451-40-2
Molecular Formula:
C9H15NO4
Molecular Weight:
201.2197
MDL Number:
MFCD23105788
IUPAC Name:
6-azaspiro[3.4]octane;oxalic acid
InChI:
InChI=1S/C7H13N.C2H2O4/c1-2-7(3-1)4-5-8-6-7;3-1(4)2(5)6/h8H,1-6H2;(H,3,4)(H,5,6)
InChI Key:
SVFZHRQWKBJNND-UHFFFAOYSA-N
SMILES:
C1CC2(C1)CCNC2.OC(=O)C(=O)O
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
201.222g/mol
Monoisotopic Mass:
201.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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