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
-2.2781 -1.1198 -0.6119 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5577 0.1219 -0.2025 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1388 -0.0782 -0.1568 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7202 0.9489 0.2009 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1957 2.0536 0.4804 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1563 0.8145 0.2668 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7730 -0.3374 -0.0195 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1353 2.1929 0.7343 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.1487 -0.9233 -1.2957 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5782 -1.8339 -1.0967 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7323 -1.6278 0.2852 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8609 0.4459 0.8127 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7713 0.9655 -0.9169 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2395 -1.2249 -0.3135 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8460 -0.3979 0.0411 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