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1823966-42-2 | 3-METHYL-6,6A-DIHYDRO-3AH-CYCLOPENTA[D]ISOXAZOL-5(4H)-ONE
CAS No: 1823966-42-2 Catalog No: AG01DKMN MDL No:
Product Description
Catalog Number:
AG01DKMN
Chemical Name:
3-METHYL-6,6A-DIHYDRO-3AH-CYCLOPENTA[D]ISOXAZOL-5(4H)-ONE
CAS Number:
1823966-42-2
IUPAC Name:
3-methyl-3a,4,6,6a-tetrahydrocyclopenta[d][1,2]oxazol-5-one
InChI:
InChI=1S/C7H9NO2/c1-4-6-2-5(9)3-7(6)10-8-4/h6-7H,2-3H2,1H3
InChI Key:
VXCBLCNTMURFPF-UHFFFAOYSA-N
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.063g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.154g/mol
Monoisotopic Mass:
139.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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