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19831-37-9 | Piperidine, 1-[2-(pentyloxy)-2-phenylethyl]-, hydrochloride (1:1)
CAS No: 19831-37-9 Catalog No: AG002BFX MDL No:
Product Description
Catalog Number:
AG002BFX
Chemical Name:
Piperidine, 1-[2-(pentyloxy)-2-phenylethyl]-, hydrochloride (1:1)
CAS Number:
19831-37-9
Molecular Formula:
C18H30ClNO
Molecular Weight:
311.8899
IUPAC Name:
1-(2-pentoxy-2-phenylethyl)piperidine;hydrochloride
InChI:
InChI=1S/C18H29NO.ClH/c1-2-3-10-15-20-18(17-11-6-4-7-12-17)16-19-13-8-5-9-14-19;/h4,6-7,11-12,18H,2-3,5,8-10,13-16H2,1H3;1H
InChI Key:
RLVMBYIXTAUOPT-UHFFFAOYSA-N
SMILES:
CCCCCOC(c1ccccc1)CN1CCCCC1.Cl
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.202g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
311.894g/mol
Monoisotopic Mass:
311.202g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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