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89082-59-7 | Cycloheptanol, 1-[4-(3-methoxyphenyl)-1-methyl-4-piperidinyl]-
CAS No: 89082-59-7 Catalog No: AG00408K MDL No:
Product Description
Catalog Number:
AG00408K
Chemical Name:
Cycloheptanol, 1-[4-(3-methoxyphenyl)-1-methyl-4-piperidinyl]-
CAS Number:
89082-59-7
Molecular Formula:
C20H31NO2
Molecular Weight:
317.4656
IUPAC Name:
1-[4-(3-methoxyphenyl)-1-methylpiperidin-4-yl]cycloheptan-1-ol
InChI:
InChI=1S/C20H31NO2/c1-21-14-12-19(13-15-21,17-8-7-9-18(16-17)23-2)20(22)10-5-3-4-6-11-20/h7-9,16,22H,3-6,10-15H2,1-2H3
InChI Key:
ODAVWXSCOPKLGY-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C1(CCN(CC1)C)C1(O)CCCCCC1
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.235g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.473g/mol
Monoisotopic Mass:
317.235g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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