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504422-72-4 | (3aR)-hexahydro-Pyrrolo[1,2-b]isoxazole
CAS No: 504422-72-4 Catalog No: AG00DOJE MDL No:
Product Description
Catalog Number:
AG00DOJE
Chemical Name:
(3aR)-hexahydro-Pyrrolo[1,2-b]isoxazole
CAS Number:
504422-72-4
IUPAC Name:
(3aR)-2,3,3a,4,5,6-hexahydropyrrolo[1,2-b][1,2]oxazole
InChI:
InChI=1S/C6H11NO/c1-2-6-3-5-8-7(6)4-1/h6H,1-5H2/t6-/m1/s1
InChI Key:
JCPMZCGVPUGJJJ-ZCFIWIBFSA-N
Properties
Complexity:
94.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
113.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
113.16g/mol
Monoisotopic Mass:
113.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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