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89805-24-3 | 2-Pentanol, 5-[(1-methyl-4-piperidinyl)amino]-1-phenoxy-
CAS No: 89805-24-3 Catalog No: AG0086Q5 MDL No:
Product Description
Catalog Number:
AG0086Q5
Chemical Name:
2-Pentanol, 5-[(1-methyl-4-piperidinyl)amino]-1-phenoxy-
CAS Number:
89805-24-3
Molecular Formula:
C17H28N2O2
Molecular Weight:
292.4164
IUPAC Name:
5-[(1-methylpiperidin-4-yl)amino]-1-phenoxypentan-2-ol
InChI:
InChI=1S/C17H28N2O2/c1-19-12-9-15(10-13-19)18-11-5-6-16(20)14-21-17-7-3-2-4-8-17/h2-4,7-8,15-16,18,20H,5-6,9-14H2,1H3
InChI Key:
MQEHCDOUUIQZOJ-UHFFFAOYSA-N
SMILES:
OC(COc1ccccc1)CCCNC1CCN(CC1)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.215g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
292.423g/mol
Monoisotopic Mass:
292.215g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
44.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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