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88544-36-9 | Piperidine, 1-(5-methoxy-1,4-cyclohexadien-1-yl)-
CAS No: 88544-36-9 Catalog No: AG004FQK MDL No:
Product Description
Catalog Number:
AG004FQK
Chemical Name:
Piperidine, 1-(5-methoxy-1,4-cyclohexadien-1-yl)-
CAS Number:
88544-36-9
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
IUPAC Name:
1-(5-methoxycyclohexa-1,4-dien-1-yl)piperidine
InChI:
InChI=1S/C12H19NO/c1-14-12-7-5-6-11(10-12)13-8-3-2-4-9-13/h6-7H,2-5,8-10H2,1H3
InChI Key:
PHFMZCQKLIPHLL-UHFFFAOYSA-N
SMILES:
COC1=CCC=C(C1)N1CCCCC1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.147g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.29g/mol
Monoisotopic Mass:
193.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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