Monomers
Ethyl 2-(hydroxymethyl)acrylate
Identifiers
IUPAC name
ethyl 2-(hydroxymethyl)prop-2-enoate
InchI
InChI=1S/C6H10O3/c1-3-9-6(8)5(2)4-7/h7H,2-4H2,1H3
InchI Key
SYGAXBISYRORDR-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)CO
Canonical SMILES
CCOC(=O)C(=C)CO
Isomeric SMILES
CCOC(=O)C(=C)CO
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H10O3
Heavy Atom Count
9
Molecular Weight
130.143
Exact Molecular Weight
130.063
Valence Electrons
52
Radical Electrons
0
tPSA
46.53
MolLogP
0.098
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
19 18 0 0 0 0 0 0 0 0999 V2000
-3.3354 0.4418 -0.1464 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1585 0.2103 0.8087 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0108 0.1011 -0.0133 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2571 -0.1129 0.4836 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3916 -0.2146 1.7228 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3908 -0.2159 -0.4001 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2406 -0.1072 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7489 -0.4464 0.1495 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1080 0.5806 1.0030 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2250 -0.3427 -0.9397 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2744 0.3325 0.4287 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1862 1.4433 -0.5736 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3249 -0.6769 1.4322 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0610 1.0753 1.5207 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2730 0.0611 -2.1645 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0824 -0.1824 -2.3865 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4923 -0.6286 -0.6487 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7007 -1.3817 0.7754 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8907 1.0548 0.6603 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 2 0
4 6 1 0
6 7 2 3
6 8 1 0
8 9 1 0
1 10 1 0
1 11 1 0
1 12 1 0
2 13 1 0
2 14 1 0
7 15 1 0
7 16 1 0
8 17 1 0
8 18 1 0
9 19 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers