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
1.9796 -0.1307 0.7063 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8007 0.2464 0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8707 1.2223 -0.7039 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4649 -0.4043 0.2791 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5524 0.0022 -0.3458 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8912 -0.0726 0.2691 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5247 -1.2362 0.9481 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5192 -0.4626 -0.2212 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4810 0.8354 -1.0128 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