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351031-52-2 | 4H-Cyclopent[d]isoxazole,3a,5,6,6a-tetrahydro-3-(1-methyl-1H-imidazol-2-yl)-(9CI)
CAS No: 351031-52-2 Catalog No: AG00CWRH MDL No:
Product Description
Catalog Number:
AG00CWRH
Chemical Name:
4H-Cyclopent[d]isoxazole,3a,5,6,6a-tetrahydro-3-(1-methyl-1H-imidazol-2-yl)-(9CI)
CAS Number:
351031-52-2
IUPAC Name:
3-(1-methylimidazol-2-yl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,2]oxazole
InChI:
InChI=1S/C10H13N3O/c1-13-6-5-11-10(13)9-7-3-2-4-8(7)14-12-9/h5-8H,2-4H2,1H3
InChI Key:
JKBMTWCHPPATON-UHFFFAOYSA-N
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.234g/mol
Monoisotopic Mass:
191.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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