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Home > Other Heterocycles > 1239852-33-5
1239852-33-5 | Carbamic acid, N-6-azaspiro[2.5]oct-1-yl-, phenylmethyl ester
CAS No: 1239852-33-5 Catalog No: AG000LB1 MDL No:MFCD20278310
Product Description
Catalog Number:
AG000LB1
Chemical Name:
Carbamic acid, N-6-azaspiro[2.5]oct-1-yl-, phenylmethyl ester
CAS Number:
1239852-33-5
Molecular Formula:
C15H20N2O2
Molecular Weight:
260.3315
MDL Number:
MFCD20278310
IUPAC Name:
benzyl N-(6-azaspiro[2.5]octan-2-yl)carbamate
InChI:
InChI=1S/C15H20N2O2/c18-14(19-11-12-4-2-1-3-5-12)17-13-10-15(13)6-8-16-9-7-15/h1-5,13,16H,6-11H2,(H,17,18)
InChI Key:
SJKOSZLPNOBVKQ-UHFFFAOYSA-N
SMILES:
O=C(NC1CC21CCNCC2)OCc1ccccc1
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.337g/mol
Monoisotopic Mass:
260.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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