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
-0.6194 -0.9770 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0162 0.1794 0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7108 1.2532 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3881 0.1195 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9333 1.0845 1.1261 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2943 -1.3473 0.2329 Cl 0 0 0 0 0 0 0 0 0 0 0 0
0.1183 -1.7866 -0.7434 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8807 -0.6132 -1.6189 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5479 -1.3042 -0.1251 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2527 2.0894 0.8067 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7387 1.3022 -0.0237 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