Monomers
Methacrylic acid 2-hydroxy-3-methoxypropyl ester
Identifiers
IUPAC name
(2-hydroxy-3-methoxypropyl) 2-methylprop-2-enoate
InchI
InChI=1S/C8H14O4/c1-6(2)8(10)12-5-7(9)4-11-3/h7,9H,1,4-5H2,2-3H3
InchI Key
BMCVSUCDMJFKSZ-UHFFFAOYSA-N
SMILES
COCC(COC(=O)C(=C)C)O
Canonical SMILES
CC(=C)C(=O)OCC(COC)O
Isomeric SMILES
CC(=C)C(=O)OCC(COC)O
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H14O4
Heavy Atom Count
12
Molecular Weight
174.196
Exact Molecular Weight
174.0892
Valence Electrons
70
Radical Electrons
0
tPSA
55.76
MolLogP
0.113
H Bond Acceptors
4
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
26 25 0 0 0 0 0 0 0 0999 V2000
3.7526 0.4189 1.2066 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9931 0.6651 0.0665 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9627 -0.2609 -0.0819 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2185 0.1133 -1.3467 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1282 -0.8484 -1.6861 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9142 -0.9140 -0.7658 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7246 0.1500 -0.4088 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4786 1.2338 -0.9694 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8089 0.0550 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1007 -1.0704 1.1704 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6212 1.2581 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1700 0.0352 -2.3886 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2189 -0.5873 1.1745 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4958 1.2330 1.2968 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0530 0.5306 2.0738 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2653 -0.2120 0.7731 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4221 -1.2630 -0.1539 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9208 1.1503 -1.2601 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6019 -1.8761 -1.7076 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1968 -0.6735 -2.7335 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8897 -1.1314 1.8706 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5107 -1.9402 0.9411 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2530 2.1393 0.2831 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5771 1.5319 1.9434 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6865 1.1395 0.6051 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5591 -0.8769 -2.3139 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 1 0
5 6 1 0
6 7 1 0
7 8 2 0
7 9 1 0
9 10 2 3
9 11 1 0
4 12 1 0
1 13 1 0
1 14 1 0
1 15 1 0
3 16 1 0
3 17 1 0
4 18 1 0
5 19 1 0
5 20 1 0
10 21 1 0
10 22 1 0
11 23 1 0
11 24 1 0
11 25 1 0
12 26 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers