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
1.4398 0.7992 0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7772 -0.3826 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4229 -1.2867 1.0151 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6270 -0.5503 0.0964 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2712 0.4422 -0.5102 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4569 0.7234 0.0025 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1283 -1.4681 0.3302 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3059 0.3569 -0.7831 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7645 1.3659 -0.7449 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