Monomers
Methacryloxyacetone
Identifiers
IUPAC name
2-oxopropyl 2-methylprop-2-enoate
InchI
InChI=1S/C7H10O3/c1-5(2)7(9)10-4-6(3)8/h1,4H2,2-3H3
InchI Key
UMNGRRUQHFCWGR-UHFFFAOYSA-N
SMILES
CC(=O)COC(=O)C(=C)C
Canonical SMILES
CC(=C)C(=O)OCC(=O)C
Isomeric SMILES
CC(=C)C(=O)OCC(=O)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H10O3
Heavy Atom Count
10
Molecular Weight
142.154
Exact Molecular Weight
142.063
Valence Electrons
56
Radical Electrons
0
tPSA
43.37
MolLogP
0.6947
H Bond Acceptors
3
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
20 19 0 0 0 0 0 0 0 0999 V2000
2.8728 1.0874 -0.2318 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7660 -0.3231 0.2174 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8009 -0.9147 0.4781 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4873 -1.0372 0.3628 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3736 -0.2648 0.0382 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8925 -0.8361 0.1382 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9535 -2.0499 0.5267 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1049 -0.1355 -0.1697 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2698 -0.7231 -0.0578 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0465 1.2713 -0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4303 1.0944 -1.2013 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9020 1.5995 -0.2879 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4686 1.6281 0.5566 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3722 -1.3620 1.4252 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4570 -1.9864 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3082 -1.7514 0.2722 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2003 -0.1961 -0.2907 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0236 1.5718 -0.9088 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3535 1.8957 0.2686 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7781 1.4322 -1.4574 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
2 4 1 0
4 5 1 0
5 6 1 0
6 7 2 0
6 8 1 0
8 9 2 3
8 10 1 0
1 11 1 0
1 12 1 0
1 13 1 0
4 14 1 0
4 15 1 0
9 16 1 0
9 17 1 0
10 18 1 0
10 19 1 0
10 20 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers