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67293-77-0 | 3,4,5,6-Tetrahydro-4-(3-phenyl-2-propenyl)-2,6-methano-2H-1,4-benzoxazocine
CAS No: 67293-77-0 Catalog No: AG00FYDS MDL No:
Product Description
Catalog Number:
AG00FYDS
Chemical Name:
3,4,5,6-Tetrahydro-4-(3-phenyl-2-propenyl)-2,6-methano-2H-1,4-benzoxazocine
CAS Number:
67293-77-0
IUPAC Name:
11-[(E)-3-phenylprop-2-enyl]-8-oxa-11-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene
InChI:
InChI=1S/C20H21NO/c1-2-7-16(8-3-1)9-6-12-21-14-17-13-18(15-21)22-20-11-5-4-10-19(17)20/h1-11,17-18H,12-15H2/b9-6+
InChI Key:
CYKYEIQTXPYZCD-RMKNXTFCSA-N
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
291.162g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.394g/mol
Monoisotopic Mass:
291.162g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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