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296803-04-8 | Cyclooct[d]isoxazole, 4,5,6,7,8,9-hexahydro-9-methyl- (9CI)
CAS No: 296803-04-8 Catalog No: AG00BOPH MDL No:
Product Description
Catalog Number:
AG00BOPH
Chemical Name:
Cyclooct[d]isoxazole, 4,5,6,7,8,9-hexahydro-9-methyl- (9CI)
CAS Number:
296803-04-8
IUPAC Name:
9-methyl-4,5,6,7,8,9-hexahydrocycloocta[d][1,2]oxazole
InChI:
InChI=1S/C10H15NO/c1-8-5-3-2-4-6-9-7-11-12-10(8)9/h7-8H,2-6H2,1H3
InChI Key:
UCARUKRTVHVXNT-UHFFFAOYSA-N
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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