2-Propynoic acid, 3-(2-naphthalenyl)-


Chemical Name: 2-Propynoic acid, 3-(2-naphthalenyl)-
CAS Number: 4843-43-0
Product Number: AG00DAWC(AGN-PC-0KLW41)
Synonyms:
MDL No:
Molecular Formula: C13H8O2
Molecular Weight: 196.2014

Identification/Properties


Computed Properties
Molecular Weight:
196.205g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
196.052g/mol
Monoisotopic Mass:
196.052g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
307
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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