Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
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
15 14 0 0 0 0 0 0 0 0999 V2000
-2.7625 -0.3599 -0.3619 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5059 0.3165 0.0822 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3410 -0.2951 -0.4593 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9026 0.2057 -0.1496 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9522 1.2019 0.6140 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1403 -0.3830 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2998 0.1526 -0.3363 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1093 -1.7679 -1.7419 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-2.6307 -1.4358 -0.6031 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4913 -0.3104 0.4879 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2536 0.1951 -1.2017 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5743 1.3928 -0.2266 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4357 0.3241 1.1929 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2348 -0.2468 -0.7006 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3562 1.0102 0.3202 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers