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89483-72-7 | 4-Piperidinamine, 1-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-
CAS No: 89483-72-7 Catalog No: AG00422H MDL No:
Product Description
Catalog Number:
AG00422H
Chemical Name:
4-Piperidinamine, 1-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-
CAS Number:
89483-72-7
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
IUPAC Name:
1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-amine
InChI:
InChI=1S/C14H20N2O2/c15-11-5-7-16(8-6-11)9-12-10-17-13-3-1-2-4-14(13)18-12/h1-4,11-12H,5-10,15H2
InChI Key:
YDVFBVTYOJECMP-UHFFFAOYSA-N
SMILES:
NC1CCN(CC1)CC1COc2c(O1)cccc2
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.152g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.326g/mol
Monoisotopic Mass:
248.152g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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