Monomers
Diphenyl vinyl phosphate
Identifiers
IUPAC name
ethenyl diphenyl phosphate
InchI
InChI=1S/C14H13O4P/c1-2-16-19(15,17-13-9-5-3-6-10-13)18-14-11-7-4-8-12-14/h2-12H,1H2
InchI Key
RJYNTEFVOZNXEM-UHFFFAOYSA-N
SMILES
C=COP(=O)(Oc1ccccc1)Oc1ccccc1
Canonical SMILES
C=COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
Isomeric SMILES
C=COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C14H13O4P
Heavy Atom Count
19
Molecular Weight
276.228
Exact Molecular Weight
276.0551
Valence Electrons
98
Radical Electrons
0
tPSA
44.76
MolLogP
4.4126
H Bond Acceptors
4
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
2
MOL File
RDKit 3D
32 33 0 0 0 0 0 0 0 0999 V2000
-0.8842 4.9663 0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2627 3.8335 0.2681 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6372 2.7075 -0.4412 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0033 1.1713 0.0305 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.0769 0.9694 1.5094 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6689 1.1891 -0.4399 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5088 0.1230 -0.1501 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8101 0.1947 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6747 -0.8600 -0.2686 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2284 -1.9764 0.4023 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9224 -2.0438 0.7973 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0776 -1.0020 0.5208 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7734 -0.0124 -0.8799 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9134 -0.6888 -0.5354 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6226 -0.5214 0.6106 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7700 -1.2708 0.8486 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2343 -2.2045 -0.0535 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5183 -2.3790 -1.2192 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3817 -1.6359 -1.4539 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6746 5.0290 -0.6989 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5923 5.8450 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5140 3.7918 0.9934 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2243 1.0251 -1.0678 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7031 -0.8392 -0.5639 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8734 -2.8113 0.6327 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5758 -2.9373 1.3313 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0336 -1.0314 0.8246 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2791 0.2054 1.3352 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3238 -1.1261 1.7657 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1385 -2.7925 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8876 -3.1172 -1.9298 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8477 -1.8012 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 1 0
7 8 2 0
8 9 1 0
9 10 2 0
10 11 1 0
11 12 2 0
4 13 1 0
13 14 1 0
14 15 2 0
15 16 1 0
16 17 2 0
17 18 1 0
18 19 2 0
12 7 1 0
19 14 1 0
1 20 1 0
1 21 1 0
2 22 1 0
8 23 1 0
9 24 1 0
10 25 1 0
11 26 1 0
12 27 1 0
15 28 1 0
16 29 1 0
17 30 1 0
18 31 1 0
19 32 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers