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
3.5471 0.8996 -1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8566 0.5197 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7094 -0.3966 -0.5002 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5065 0.2065 -0.0146 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6627 -0.5465 -0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6023 -1.7227 -0.5003 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9375 -0.0565 0.4129 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0557 1.1554 0.8935 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1289 -0.9152 0.3471 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2474 0.5168 -2.4281 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3882 1.5689 -1.4112 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1355 0.8912 0.5919 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5387 -0.6430 -1.5727 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9329 -1.3311 0.0307 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1773 1.7871 0.9415 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0255 1.5306 1.2432 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2805 -1.2825 -0.6899 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9515 -1.7722 1.0437 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0402 -0.4095 0.7327 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