Monomers
Acrylic acid
Identifiers
IUPAC name
prop-2-enoic acid
InchI
InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)
InchI Key
NIXOWILDQLNWCW-UHFFFAOYSA-N
SMILES
OC(=O)C=C
Canonical SMILES
C=CC(=O)O
Isomeric SMILES
C=CC(=O)O
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C3H4O2
Heavy Atom Count
5
Molecular Weight
72.063
Exact Molecular Weight
72.0211
Valence Electrons
28
Radical Electrons
0
tPSA
37.3
MolLogP
0.257
H Bond Acceptors
1
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
9 8 0 0 0 0 0 0 0 0999 V2000
1.1533 -1.2220 0.2326 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9124 0.1443 0.2922 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8893 0.8654 0.5907 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4012 0.7340 0.0254 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4179 -0.0651 -0.2894 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0655 -1.5029 -0.1031 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5162 1.7855 0.0883 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3089 -1.1308 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3762 0.3916 -0.4817 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
2 4 1 0
4 5 2 3
1 6 1 0
4 7 1 0
5 8 1 0
5 9 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers