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
2.6914 0.5763 0.0771 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2638 0.5436 0.0068 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5808 -0.5909 0.3794 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2043 -1.6013 0.7822 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8768 -0.5935 0.2965 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5290 -1.6847 0.6552 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6250 0.5944 -0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3543 1.6860 0.6614 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0061 0.4562 1.1314 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0639 1.5010 -0.3708 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0286 -0.3449 -0.4573 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6066 -1.6989 0.5984 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0460 -2.5779 1.0073 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3842 0.8196 -1.2296 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7144 0.3974 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7026 2.5175 0.2978 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