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14585-29-6 | 1-Piperidineethanol, α-[(phenylamino)methyl]-
CAS No: 14585-29-6 Catalog No: AG001DGU MDL No:
Product Description
Catalog Number:
AG001DGU
Chemical Name:
1-Piperidineethanol, α-[(phenylamino)methyl]-
CAS Number:
14585-29-6
Molecular Formula:
C14H22N2O
Molecular Weight:
234.3373
IUPAC Name:
1-anilino-3-piperidin-1-ylpropan-2-ol
InChI:
InChI=1S/C14H22N2O/c17-14(12-16-9-5-2-6-10-16)11-15-13-7-3-1-4-8-13/h1,3-4,7-8,14-15,17H,2,5-6,9-12H2
InChI Key:
RXEWLSQUHJUOJX-UHFFFAOYSA-N
SMILES:
OC(CN1CCCCC1)CNc1ccccc1
NSC Number:
153671
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.173g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.343g/mol
Monoisotopic Mass:
234.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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