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
-2.9479 0.4759 0.5095 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3927 -0.5785 -0.4085 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0303 -0.8259 -0.2105 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0217 0.1045 -0.3441 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3640 1.2760 -0.6730 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3893 -0.2149 -0.1231 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7577 -1.4181 0.2164 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4182 0.8382 -0.2856 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6758 0.3459 -0.0364 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5806 0.3819 1.5492 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0535 0.4034 0.5451 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7127 1.4945 0.1395 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6748 -0.3381 -1.4384 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9331 -1.5345 -0.1495 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8049 -1.6266 0.3732 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0762 -2.2512 0.3582 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2251 1.7304 0.3388 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3947 1.1216 -1.3783 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9692 0.6155 0.8794 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