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1353945-01-3 | 2-(1-Methyl-piperidin-3-ylamino)-ethanol
CAS No: 1353945-01-3 Catalog No: AG01FBYY MDL No:
Product Description
Catalog Number:
AG01FBYY
Chemical Name:
2-(1-Methyl-piperidin-3-ylamino)-ethanol
CAS Number:
1353945-01-3
Molecular Formula:
C8H18N2O
Molecular Weight:
158.2413
IUPAC Name:
2-[(1-methylpiperidin-3-yl)amino]ethanol
InChI:
InChI=1S/C8H18N2O/c1-10-5-2-3-8(7-10)9-4-6-11/h8-9,11H,2-7H2,1H3
InChI Key:
LYYRWEHVYQLWFD-UHFFFAOYSA-N
SMILES:
OCCNC1CCCN(C1)C
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.142g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
158.245g/mol
Monoisotopic Mass:
158.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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