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
-0.9104 -0.9920 -0.3086 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0362 0.1124 0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3712 1.2293 0.5861 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4466 -0.0571 -0.2451 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8813 -1.1304 -0.7796 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5635 1.2320 0.1560 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-0.5881 -1.9651 0.1213 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0822 -1.0262 -1.3905 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8878 -0.7590 0.2073 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3317 1.9972 0.8195 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4197 1.3588 0.7970 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