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71412-24-3 | 1-Piperidineethanol,4,4'-[1-(4-piperidinyl)-1,3-propanediyl]bis- (9CI)
CAS No: 71412-24-3 Catalog No: AG005IRI MDL No:
Product Description
Catalog Number:
AG005IRI
Chemical Name:
1-Piperidineethanol,4,4'-[1-(4-piperidinyl)-1,3-propanediyl]bis- (9CI)
CAS Number:
71412-24-3
Molecular Formula:
C22H43N3O2
Molecular Weight:
381.5957
IUPAC Name:
2-[4-[3-[1-(2-hydroxyethyl)piperidin-4-yl]-3-piperidin-4-ylpropyl]piperidin-1-yl]ethanol
InChI:
InChI=1S/C22H43N3O2/c26-17-15-24-11-5-19(6-12-24)1-2-22(20-3-9-23-10-4-20)21-7-13-25(14-8-21)16-18-27/h19-23,26-27H,1-18H2
InChI Key:
GUHDBMMUZOUAPA-UHFFFAOYSA-N
SMILES:
OCCN1CCC(CC1)CCC(C1CCN(CC1)CCO)C1CCNCC1
EC Number:
275-430-7
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.336g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
381.605g/mol
Monoisotopic Mass:
381.336g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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