Monomers
Methacryloyl chloride
Identifiers
IUPAC name
2-methylprop-2-enoyl chloride
InchI
InChI=1S/C4H5ClO/c1-3(2)4(5)6/h1H2,2H3
InchI Key
VHRYZQNGTZXDNX-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)Cl
Canonical SMILES
CC(=C)C(=O)Cl
Isomeric SMILES
CC(=C)C(=O)Cl
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H5ClO
Heavy Atom Count
6
Molecular Weight
104.536
Exact Molecular Weight
104.0029
Valence Electrons
34
Radical Electrons
0
tPSA
17.07
MolLogP
1.3279
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
11 10 0 0 0 0 0 0 0 0999 V2000
-0.8980 -0.8206 -0.5023 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0484 0.2026 0.0333 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2130 1.4916 -0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2877 -0.2727 0.6141 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0906 0.5990 1.0687 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6115 -1.9700 0.6612 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-0.2840 -1.6411 -0.9315 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4281 -1.2676 0.3667 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5881 -0.3918 -1.2529 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1229 1.8771 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4959 2.1935 0.3869 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
2 4 1 0
4 5 2 0
4 6 1 0
1 7 1 0
1 8 1 0
1 9 1 0
3 10 1 0
3 11 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers