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Home > Other Heterocycles > 2060032-51-9
2060032-51-9 | 3-{1,4-dioxaspiro[4.5]decan-8-yl}-2-methylaniline
CAS No: 2060032-51-9 Catalog No: AG01BY57 MDL No:MFCD30488461
Product Description
Catalog Number:
AG01BY57
Chemical Name:
3-{1,4-dioxaspiro[4.5]decan-8-yl}-2-methylaniline
CAS Number:
2060032-51-9
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
MDL Number:
MFCD30488461
IUPAC Name:
3-(1,4-dioxaspiro[4.5]decan-8-yl)-2-methylaniline
InChI:
InChI=1S/C15H21NO2/c1-11-13(3-2-4-14(11)16)12-5-7-15(8-6-12)17-9-10-18-15/h2-4,12H,5-10,16H2,1H3
InChI Key:
UWBRNGDOMDRNGA-UHFFFAOYSA-N
SMILES:
Cc1c(cccc1N)C1CCC2(CC1)OCCO2
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.157g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.338g/mol
Monoisotopic Mass:
247.157g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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