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Home > Other Heterocycles > 84060-09-3
84060-09-3 | Spiro[4H-3,1-benzoxazine-4,4'-piperidin]-2(1H)-one
CAS No: 84060-09-3 Catalog No: AG004T79 MDL No:MFCD10566067
Product Description
Catalog Number:
AG004T79
Chemical Name:
Spiro[4H-3,1-benzoxazine-4,4'-piperidin]-2(1H)-one
CAS Number:
84060-09-3
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
MDL Number:
MFCD10566067
IUPAC Name:
spiro[1H-3,1-benzoxazine-4,4'-piperidine]-2-one
InChI:
InChI=1S/C12H14N2O2/c15-11-14-10-4-2-1-3-9(10)12(16-11)5-7-13-8-6-12/h1-4,13H,5-8H2,(H,14,15)
InChI Key:
NHUBGKMFTPUSRP-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccccc2C2(O1)CCNCC2
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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