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20009-28-3 | Naphthalene, 2-(2-propyn-1-yloxy)-
CAS No: 20009-28-3 Catalog No: AG002CJB MDL No:
Product Description
Catalog Number:
AG002CJB
Chemical Name:
Naphthalene, 2-(2-propyn-1-yloxy)-
CAS Number:
20009-28-3
Molecular Formula:
C13H10O
Molecular Weight:
182.2179
IUPAC Name:
2-prop-2-ynoxynaphthalene
InChI:
InChI=1S/C13H10O/c1-2-9-14-13-8-7-11-5-3-4-6-12(11)10-13/h1,3-8,10H,9H2
InChI Key:
RACCOFGYHHVUQB-UHFFFAOYSA-N
SMILES:
C#CCOc1ccc2c(c1)cccc2
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.073g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.222g/mol
Monoisotopic Mass:
182.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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