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
3.9067 -0.0191 0.4152 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5293 -0.5833 0.3663 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3990 -1.7720 0.5850 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4191 0.3398 0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1662 -0.3186 0.0402 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9803 0.4100 -0.2362 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8482 1.6355 -0.4620 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3055 -0.1755 -0.2747 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4575 -1.4725 -0.0371 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4599 0.7025 -0.5814 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6551 -0.7102 -0.0249 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9508 0.9815 -0.0629 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1251 0.1591 1.5089 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6488 0.7793 -0.9564 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3635 1.1948 0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5954 -2.0830 0.1831 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4180 -1.9649 -0.0516 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6316 1.3257 0.3274 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3563 0.1451 -0.8894 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1111 1.4258 -1.3766 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