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27827-62-9 | 3,4-Dihydro-6-phenethyl-2H-1,5-benzoxazocin-3-ol
CAS No: 27827-62-9 Catalog No: AG00BQYU MDL No:
Product Description
Catalog Number:
AG00BQYU
Chemical Name:
3,4-Dihydro-6-phenethyl-2H-1,5-benzoxazocin-3-ol
CAS Number:
27827-62-9
IUPAC Name:
6-(2-phenylethyl)-3,4-dihydro-2H-1,5-benzoxazocin-3-ol
InChI:
InChI=1S/C18H19NO2/c20-15-12-19-17(11-10-14-6-2-1-3-7-14)16-8-4-5-9-18(16)21-13-15/h1-9,15,20H,10-13H2
InChI Key:
WKEFGSVJSRPUMA-UHFFFAOYSA-N
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.142g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.355g/mol
Monoisotopic Mass:
281.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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