Home Other Building Blocks diethyl (prop-1-yn-1-yl)phosphonate

diethyl (prop-1-yn-1-yl)phosphonate

CAS No.:
1067-88-5
Catalog Number:
AG019P4W
Molecular Formula:
C7H13O3P
Molecular Weight:
176.1501
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Product Description
Catalog Number:
AG019P4W
Chemical Name:
diethyl (prop-1-yn-1-yl)phosphonate
CAS Number:
1067-88-5
Molecular Formula:
C7H13O3P
Molecular Weight:
176.1501
MDL Number:
MFCD00463611
IUPAC Name:
1-diethoxyphosphorylprop-1-yne
InChI:
InChI=1S/C7H13O3P/c1-4-7-11(8,9-5-2)10-6-3/h5-6H2,1-3H3
InChI Key:
QJUYNZSVUSXZFS-UHFFFAOYSA-N
SMILES:
CCOP(=O)(C#CC)OCC
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.06g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.152g/mol
Monoisotopic Mass:
176.06g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties