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148258-44-0 | 2-Naphthalenol, 5,6,7,8-tetrahydro-7-(propyl-2-propyn-1-ylamino)-
CAS No: 148258-44-0 Catalog No: AG001FK2 MDL No:
Product Description
Catalog Number:
AG001FK2
Chemical Name:
2-Naphthalenol, 5,6,7,8-tetrahydro-7-(propyl-2-propyn-1-ylamino)-
CAS Number:
148258-44-0
Molecular Formula:
C16H21NO
Molecular Weight:
243.3440
IUPAC Name:
7-[propyl(prop-2-ynyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
InChI:
InChI=1S/C16H21NO/c1-3-9-17(10-4-2)15-7-5-13-6-8-16(18)12-14(13)11-15/h1,6,8,12,15,18H,4-5,7,9-11H2,2H3
InChI Key:
ABWBPOZDOXARFZ-UHFFFAOYSA-N
SMILES:
CCCN(C1CCc2c(C1)cc(cc2)O)CC#C
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.162g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.35g/mol
Monoisotopic Mass:
243.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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