Monomers
Methyl 2-(hydroxymethyl)acrylate
Identifiers
IUPAC name
methyl 2-(hydroxymethyl)prop-2-enoate
InchI
InChI=1S/C5H8O3/c1-4(3-6)5(7)8-2/h6H,1,3H2,2H3
InchI Key
RFUCOAQWQVDBEU-UHFFFAOYSA-N
SMILES
COC(=O)C(=C)CO
Canonical SMILES
COC(=O)C(=C)CO
Isomeric SMILES
COC(=O)C(=C)CO
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H8O3
Heavy Atom Count
8
Molecular Weight
116.116
Exact Molecular Weight
116.0473
Valence Electrons
46
Radical Electrons
0
tPSA
46.53
MolLogP
-0.2921
H Bond Acceptors
3
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
16 15 0 0 0 0 0 0 0 0999 V2000
2.8235 -0.1656 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4390 -0.1351 0.7700 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4701 -0.1400 -0.2233 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8954 -0.1725 -1.4062 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9329 -0.1094 0.1015 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3024 -0.0760 1.3731 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0058 -0.1136 -0.9355 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8328 0.9983 -1.7187 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0265 0.4900 -0.4558 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1457 -1.2030 0.1661 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4431 0.2400 1.2633 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5715 -0.0713 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3284 -0.0524 1.6642 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0133 -0.1413 -0.4828 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8900 -1.0723 -1.4875 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3662 1.7242 -1.2373 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
3 5 1 0
5 6 2 3
5 7 1 0
7 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
6 12 1 0
6 13 1 0
7 14 1 0
7 15 1 0
8 16 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers