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
2.9609 1.2374 -0.2071 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1683 0.0070 0.0708 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7654 0.2195 -0.0908 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0586 -0.8729 0.1472 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4326 -1.9801 0.4864 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5105 -0.7917 0.0179 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2808 -1.8401 0.2479 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1774 0.4740 -0.3775 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8435 1.4344 0.5982 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3849 2.0713 -0.6145 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5030 1.5073 0.7443 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7868 0.9875 -0.9312 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3003 -0.3932 1.0923 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4170 -0.8418 -0.6268 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8174 -2.7730 0.5373 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3468 -1.8009 0.1585 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2661 0.3835 -0.3544 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8875 0.8101 -1.3901 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5306 2.1616 0.4916 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