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107770-22-9 | 4H-Cyclopent[d]isoxazole,3a,5,6,6a-tetrahydro-3-(1-methylethyl)-,cis-(9CI)
CAS No: 107770-22-9 Catalog No: AG009PD5 MDL No:
Product Description
Catalog Number:
AG009PD5
Chemical Name:
4H-Cyclopent[d]isoxazole,3a,5,6,6a-tetrahydro-3-(1-methylethyl)-,cis-(9CI)
CAS Number:
107770-22-9
IUPAC Name:
(3aS,6aS)-3-propan-2-yl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,2]oxazole
InChI:
InChI=1S/C9H15NO/c1-6(2)9-7-4-3-5-8(7)11-10-9/h6-8H,3-5H2,1-2H3/t7-,8+/m1/s1
InChI Key:
IPISWPVMASXWEC-SFYZADRCSA-N
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
153.115g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.225g/mol
Monoisotopic Mass:
153.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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