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760918-49-8 | 4H-Isoxazolo[5,4-c]azepine,5,6,7,8-tetrahydro-3-methoxy-(9CI)
CAS No: 760918-49-8 Catalog No: AG00GDRE MDL No:
Product Description
Catalog Number:
AG00GDRE
Chemical Name:
4H-Isoxazolo[5,4-c]azepine,5,6,7,8-tetrahydro-3-methoxy-(9CI)
CAS Number:
760918-49-8
IUPAC Name:
3-methoxy-5,6,7,8-tetrahydro-4H-[1,2]oxazolo[5,4-c]azepine
InChI:
InChI=1S/C8H12N2O2/c1-11-8-6-3-2-4-9-5-7(6)12-10-8/h9H,2-5H2,1H3
InChI Key:
MOJTYBHOMNMHRW-UHFFFAOYSA-N
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.196g/mol
Monoisotopic Mass:
168.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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