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Home > Other Heterocycles > 1427358-60-8
1427358-60-8 | 1-oxa-6-azaspiro[3.3]heptane; oxalic acid
CAS No: 1427358-60-8 Catalog No: AG00HWKT MDL No:MFCD17214340
Product Description
Catalog Number:
AG00HWKT
Chemical Name:
1-oxa-6-azaspiro[3.3]heptane; oxalic acid
CAS Number:
1427358-60-8
Molecular Formula:
C7H11NO5
Molecular Weight:
189.1659
MDL Number:
MFCD17214340
IUPAC Name:
1-oxa-6-azaspiro[3.3]heptane;oxalic acid
InChI:
InChI=1S/C5H9NO.C2H2O4/c1-2-7-5(1)3-6-4-5;3-1(4)2(5)6/h6H,1-4H2;(H,3,4)(H,5,6)
InChI Key:
HEQQLMIYMDQAPT-UHFFFAOYSA-N
SMILES:
C1CC2(O1)CNC2.OC(=O)C(=O)O
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
189.167g/mol
Monoisotopic Mass:
189.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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