Monomers
Diethyl vinyl phosphate
Identifiers
IUPAC name
ethenyl diethyl phosphate
InchI
InChI=1S/C6H13O4P/c1-4-8-11(7,9-5-2)10-6-3/h4H,1,5-6H2,2-3H3
InchI Key
ULUJSLFWDQSXRS-UHFFFAOYSA-N
SMILES
CCOP(=O)(OC=C)OCC
Canonical SMILES
CCOP(=O)(OCC)OC=C
Isomeric SMILES
CCOP(=O)(OCC)OC=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H13O4P
Heavy Atom Count
11
Molecular Weight
180.14
Exact Molecular Weight
180.0551
Valence Electrons
66
Radical Electrons
0
tPSA
44.76
MolLogP
2.3276
H Bond Acceptors
4
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
24 23 0 0 0 0 0 0 0 0999 V2000
3.1797 -1.1865 -0.0571 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2455 -0.6138 0.9978 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9631 -1.0986 0.7307 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0787 0.0923 -0.0101 P 0 0 0 0 0 5 0 0 0 0 0 0
0.7500 0.2941 -1.4345 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1768 1.6419 0.7157 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1226 2.7509 -0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6983 3.7205 -0.1621 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4764 -0.2929 -0.3990 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8915 -1.5234 0.0633 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3386 -1.6379 -0.4015 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7313 -2.0575 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3411 -0.3553 -0.8343 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1305 -1.4145 0.3719 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5296 -1.1964 1.9484 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3666 0.4178 1.2092 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9847 2.7423 -0.8316 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5562 4.5236 -0.9262 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5434 3.9057 0.4691 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2905 -2.3185 -0.4004 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8167 -1.5883 1.1803 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3272 -1.5568 -1.5001 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8259 -2.5468 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8354 -0.7019 -0.0515 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 1 0
7 8 2 3
4 9 1 0
9 10 1 0
10 11 1 0
1 12 1 0
1 13 1 0
1 14 1 0
2 15 1 0
2 16 1 0
7 17 1 0
8 18 1 0
8 19 1 0
10 20 1 0
10 21 1 0
11 22 1 0
11 23 1 0
11 24 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers