Home Aminos 3-[4-(1-aminoethyl)phenyl]-1,3-oxazinan-2-one

3-[4-(1-aminoethyl)phenyl]-1,3-oxazinan-2-one

CAS No.:
1468499-96-8
Catalog Number:
AG01ALQJ
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
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Product Description
Catalog Number:
AG01ALQJ
Chemical Name:
3-[4-(1-aminoethyl)phenyl]-1,3-oxazinan-2-one
CAS Number:
1468499-96-8
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
MDL Number:
MFCD21213625
IUPAC Name:
3-[4-(1-aminoethyl)phenyl]-1,3-oxazinan-2-one
InChI:
InChI=1S/C12H16N2O2/c1-9(13)10-3-5-11(6-4-10)14-7-2-8-16-12(14)15/h3-6,9H,2,7-8,13H2,1H3
InChI Key:
BPBBHFHPMGPTKW-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)N1CCCOC1=O)N
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.272g/mol
Monoisotopic Mass:
220.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties