Monomers
Furfuryl methacrylate
Identifiers
IUPAC name
furan-2-ylmethyl 2-methylprop-2-enoate
InchI
InChI=1S/C9H10O3/c1-7(2)9(10)12-6-8-4-3-5-11-8/h3-5H,1,6H2,2H3
InchI Key
DWXAVNJYFLGAEF-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OCc1ccco1
Canonical SMILES
CC(=C)C(=O)OCC1=CC=CO1
Isomeric SMILES
CC(=C)C(=O)OCC1=CC=CO1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C9H10O3
Heavy Atom Count
12
Molecular Weight
166.176
Exact Molecular Weight
166.063
Valence Electrons
64
Radical Electrons
0
tPSA
39.44
MolLogP
1.8989
H Bond Acceptors
3
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
22 22 0 0 0 0 0 0 0 0999 V2000
-3.2689 0.2024 0.8687 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4122 0.0682 -0.3279 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8984 0.4052 -1.5012 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0311 -0.4400 -0.1842 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6069 -0.7499 0.9520 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1876 -0.5881 -1.2491 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1327 -1.0608 -1.2049 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0350 -0.2395 -0.3601 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3470 -0.4520 0.9656 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2305 0.5620 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3935 1.3272 0.2253 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6806 0.8282 -0.7547 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6696 -0.7693 1.1912 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1252 0.8725 0.6665 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7260 0.6417 1.7329 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2782 0.3084 -2.3704 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8975 0.7728 -1.6049 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5539 -1.2087 -2.2289 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0635 -2.1127 -0.7925 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0070 -1.2342 1.6284 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6589 0.6706 2.3439 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9989 2.1960 0.1309 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
2 4 1 0
4 5 2 0
4 6 1 0
6 7 1 0
7 8 1 0
8 9 2 0
9 10 1 0
10 11 2 0
11 12 1 0
12 8 1 0
1 13 1 0
1 14 1 0
1 15 1 0
3 16 1 0
3 17 1 0
7 18 1 0
7 19 1 0
9 20 1 0
10 21 1 0
11 22 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers