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
-1.3313 0.1556 0.3044 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1233 0.0575 0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9853 0.9847 0.3223 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5789 -1.1417 -0.6783 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2098 -2.0671 -1.0083 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2797 -1.2931 -1.0479 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.9518 0.2921 -0.5888 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6429 -0.7779 0.8249 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4620 1.0508 0.9491 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5967 1.8646 0.8325 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0340 0.8744 0.0859 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