Benzaldehyde, 2-ethynyl-


Chemical Name: Benzaldehyde, 2-ethynyl-
CAS Number: 38846-64-9
Product Number: AG003H8A(AGN-PC-0JU78M)
Synonyms:
MDL No:
Molecular Formula: C9H6O
Molecular Weight: 130.1433

Identification/Properties


Properties
MP:
64-67 °C(lit.)
BP:
230.3°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
130.146g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
130.042g/mol
Monoisotopic Mass:
130.042g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
163
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

Safety Information


NMR Spectrum


Other Analytical Data


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