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
1.5584 -1.2936 0.2492 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8134 -0.2104 -0.1804 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4244 0.7677 -0.6692 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6399 -0.2353 -0.0551 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3157 0.8000 -0.4686 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5159 -1.1644 0.6089 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1541 -1.1005 0.3752 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3769 0.7925 -0.3818 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8255 1.6440 -0.8874 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