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
-1.1626 -0.6916 -0.2188 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0677 0.1038 0.0317 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0267 1.3538 0.4443 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3557 -0.5215 -0.1861 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4997 -1.7014 -0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8289 0.3896 0.1003 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.2763 -1.4830 0.5568 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0282 -1.2076 -1.1791 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0589 -0.0326 -0.2197 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0089 1.7993 0.6001 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8095 1.9912 0.6464 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