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639091-96-6 | 5H-6,7a-Methano-1H,3H-pyrrolo[1,2-c]oxazole(9CI)
CAS No: 639091-96-6 Catalog No: AG00EW6P MDL No:
Product Description
Catalog Number:
AG00EW6P
Chemical Name:
5H-6,7a-Methano-1H,3H-pyrrolo[1,2-c]oxazole(9CI)
CAS Number:
639091-96-6
IUPAC Name:
3-oxa-5-azatricyclo[5.1.1.01,5]non-7-ene
InChI:
InChI=1S/C7H9NO/c1-6-2-7(1)4-9-5-8(7)3-6/h1H,2-5H2
InChI Key:
OEHNGCVCWBHWRN-UHFFFAOYSA-N
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
123.155g/mol
Monoisotopic Mass:
123.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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