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Home > Other Heterocycles > 2060046-01-5
2060046-01-5 | 2-{1,4-dioxaspiro[4.5]decan-8-yl}-3-methylaniline
CAS No: 2060046-01-5 Catalog No: AG01BY66 MDL No:MFCD30488632
Product Description
Catalog Number:
AG01BY66
Chemical Name:
2-{1,4-dioxaspiro[4.5]decan-8-yl}-3-methylaniline
CAS Number:
2060046-01-5
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
MDL Number:
MFCD30488632
IUPAC Name:
2-(1,4-dioxaspiro[4.5]decan-8-yl)-3-methylaniline
InChI:
InChI=1S/C15H21NO2/c1-11-3-2-4-13(16)14(11)12-5-7-15(8-6-12)17-9-10-18-15/h2-4,12H,5-10,16H2,1H3
InChI Key:
YLGFHLHHYFJJCJ-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1C1CCC2(CC1)OCCO2)N
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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