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
-2.3036 -0.3248 0.1407 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5724 0.7532 -0.6219 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2611 0.9661 -0.1284 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7140 -0.0159 -0.0998 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3936 -1.1460 -0.5403 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0664 0.2506 0.4232 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9785 -0.6993 0.4406 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4962 1.8344 1.0344 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.3915 -0.0449 0.1238 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1171 -1.2844 -0.3688 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0146 -0.3558 1.1966 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5927 0.5348 -1.6982 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1162 1.7181 -0.4675 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7612 -1.6951 0.0737 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9590 -0.4911 0.8241 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