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75052-54-9 | Naphthalene, 2-(propylthio)-
CAS No: 75052-54-9 Catalog No: AG005ENJ MDL No:
Product Description
Catalog Number:
AG005ENJ
Chemical Name:
Naphthalene, 2-(propylthio)-
CAS Number:
75052-54-9
Molecular Formula:
C13H14S
Molecular Weight:
202.3153
IUPAC Name:
2-propylsulfanylnaphthalene
InChI:
InChI=1S/C13H14S/c1-2-9-14-13-8-7-11-5-3-4-6-12(11)10-13/h3-8,10H,2,9H2,1H3
InChI Key:
COLCRCSUSPICGD-UHFFFAOYSA-N
SMILES:
CCCSc1ccc2c(c1)cccc2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.082g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.315g/mol
Monoisotopic Mass:
202.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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