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
2.7985 -0.3016 0.2828 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4998 -0.4712 -0.3021 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3571 0.0016 0.3192 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4368 0.5942 1.4181 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9351 -0.1855 -0.2962 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0253 -0.8087 -1.4526 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1316 0.3397 0.4095 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9709 1.7096 0.5511 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5299 -0.9207 -0.2309 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7188 -0.5661 1.3675 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0347 0.7790 0.1784 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1267 -1.1697 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9667 -0.9750 -1.9557 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0922 -0.0844 1.4513 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0670 0.0674 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0603 1.9916 0.2941 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