Monomers
Allyl methacrylate
Identifiers
IUPAC name
prop-2-enyl 2-methylprop-2-enoate
InchI
InChI=1S/C7H10O2/c1-4-5-9-7(8)6(2)3/h4H,1-2,5H2,3H3
InchI Key
FBCQUCJYYPMKRO-UHFFFAOYSA-N
SMILES
C=CCOC(=O)C(=C)C
Canonical SMILES
CC(=C)C(=O)OCC=C
Isomeric SMILES
CC(=C)C(=O)OCC=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H10O2
Heavy Atom Count
9
Molecular Weight
126.155
Exact Molecular Weight
126.0681
Valence Electrons
50
Radical Electrons
0
tPSA
26.3
MolLogP
1.2917
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
19 18 0 0 0 0 0 0 0 0999 V2000
3.0867 -0.5314 -0.9328 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4328 0.3591 -0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7778 -0.0322 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3863 0.2304 0.9627 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4450 -0.3330 0.0323 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0337 -1.1386 -0.7992 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8628 -0.0093 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6816 -0.5488 -0.8976 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4093 0.9526 1.0006 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1451 -1.5377 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5630 -0.2432 -1.8586 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3623 1.3885 -0.5302 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1746 0.5946 1.8781 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9793 -1.1066 1.2965 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2975 -1.2438 -1.6238 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7108 -0.2945 -0.8977 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7939 0.8359 1.9161 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2677 1.9625 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4730 0.6958 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 1 0
5 6 2 0
5 7 1 0
7 8 2 3
7 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
3 13 1 0
3 14 1 0
8 15 1 0
8 16 1 0
9 17 1 0
9 18 1 0
9 19 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers