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1160246-74-1 | 2,6-Diazaspiro[4.5]decane-2-carboxylic acid, 7-oxo-, phenylmethyl ester
CAS No: 1160246-74-1 Catalog No: AG000BEJ MDL No:MFCD12198508
Product Description
Catalog Number:
AG000BEJ
Chemical Name:
2,6-Diazaspiro[4.5]decane-2-carboxylic acid, 7-oxo-, phenylmethyl ester
CAS Number:
1160246-74-1
Molecular Formula:
C16H20N2O3
Molecular Weight:
288.3416
MDL Number:
MFCD12198508
IUPAC Name:
benzyl 7-oxo-2,6-diazaspiro[4.5]decane-2-carboxylate
InChI:
InChI=1S/C16H20N2O3/c19-14-7-4-8-16(17-14)9-10-18(12-16)15(20)21-11-13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2,(H,17,19)
InChI Key:
KBVZXTSTUKGUBY-UHFFFAOYSA-N
SMILES:
O=C1CCCC2(N1)CCN(C2)C(=O)OCc1ccccc1
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.147g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.347g/mol
Monoisotopic Mass:
288.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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