2-Butyn-1-ol, 4-(methylamino)-


Chemical Name: 2-Butyn-1-ol, 4-(methylamino)-
CAS Number: 118264-47-4
Product Number: AG00HEFN(AGN-PC-00003W)
Synonyms:
MDL No:
Molecular Formula: C5H9NO
Molecular Weight: 99.13106

Identification/Properties


Computed Properties
Molecular Weight:
99.133g/mol
XLogP3:
-0.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
99.068g/mol
Monoisotopic Mass:
99.068g/mol
Topological Polar Surface Area:
32.3A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
86.7
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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