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
3.2825 0.3138 1.7196 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8312 0.8454 0.5007 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9302 -0.0961 -0.0159 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3589 0.3513 -1.3433 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3472 -0.6533 -1.7757 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7131 -0.8336 -0.8686 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6009 0.1556 -0.4757 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4228 1.3069 -0.9909 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6797 -0.0880 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8736 -1.2681 1.0061 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5757 1.0273 0.8277 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3948 0.5148 -2.2432 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0002 0.9607 2.2299 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7793 -0.6612 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3995 0.0344 2.3261 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0846 -0.1701 0.7035 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4775 -1.0464 -0.0872 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8831 1.3324 -1.1694 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0241 -0.4613 -2.8098 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8525 -1.6618 -1.8508 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2118 -2.0778 0.7366 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6659 -1.4511 1.7013 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5848 0.6463 1.0856 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6807 1.7451 -0.0328 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1218 1.5608 1.6842 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5333 -0.3258 -2.7691 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