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100632-50-6 | 1-Naphthalenol, 5,6,7,8-tetrahydro-5-(1-piperidinylmethyl)-
CAS No: 100632-50-6 Catalog No: AG0002IO MDL No:
Product Description
Catalog Number:
AG0002IO
Chemical Name:
1-Naphthalenol, 5,6,7,8-tetrahydro-5-(1-piperidinylmethyl)-
CAS Number:
100632-50-6
Molecular Formula:
C16H23NO
Molecular Weight:
245.3599
IUPAC Name:
5-(piperidin-1-ylmethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
InChI:
InChI=1S/C16H23NO/c18-16-9-5-7-14-13(6-4-8-15(14)16)12-17-10-2-1-3-11-17/h5,7,9,13,18H,1-4,6,8,10-12H2
InChI Key:
BQSZWSBIRSECFA-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1CCCC2CN1CCCCC1
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.178g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.366g/mol
Monoisotopic Mass:
245.178g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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