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28819-40-1 | 2H-1,3-Oxazine, tetrahydro-3-phenyl-
CAS No: 28819-40-1 Catalog No: AG002WNA MDL No:
Product Description
Catalog Number:
AG002WNA
Chemical Name:
2H-1,3-Oxazine, tetrahydro-3-phenyl-
CAS Number:
28819-40-1
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
IUPAC Name:
3-phenyl-1,3-oxazinane
InChI:
InChI=1S/C10H13NO/c1-2-5-10(6-3-1)11-7-4-8-12-9-11/h1-3,5-6H,4,7-9H2
InChI Key:
SZDCFKYCMWJHEG-UHFFFAOYSA-N
SMILES:
C1CCN(CO1)c1ccccc1
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.22g/mol
Monoisotopic Mass:
163.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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