Monomers
2-Chloroethyl methacrylate
Identifiers
IUPAC name
2-chloroethyl 2-methylprop-2-enoate
InchI
InChI=1S/C6H9ClO2/c1-5(2)6(8)9-4-3-7/h1,3-4H2,2H3
InchI Key
GPOGMJLHWQHEGF-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OCCCl
Canonical SMILES
CC(=C)C(=O)OCCCl
Isomeric SMILES
CC(=C)C(=O)OCCCl
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H9ClO2
Heavy Atom Count
9
Molecular Weight
148.589
Exact Molecular Weight
148.0291
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.3445
H Bond Acceptors
2
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
18 17 0 0 0 0 0 0 0 0999 V2000
-2.7611 0.8586 -0.7788 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6929 0.0863 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0322 -0.9267 0.6533 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2962 0.4822 -0.2853 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0169 1.4526 -1.0079 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7380 -0.2001 0.3249 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0711 0.2214 0.1116 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0398 -0.6540 0.8649 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8437 -2.3212 0.2792 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.2035 1.5872 -0.0825 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3474 1.4488 -1.6352 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4812 0.1526 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2718 -1.4959 1.1536 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0646 -1.1891 0.7694 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1945 1.3002 0.3579 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3521 0.1310 -0.9784 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8619 -0.5824 1.9643 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0668 -0.3515 0.6649 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
6 7 1 0
7 8 1 0
8 9 1 0
1 10 1 0
1 11 1 0
1 12 1 0
3 13 1 0
3 14 1 0
7 15 1 0
7 16 1 0
8 17 1 0
8 18 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers