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
4.0259 -0.1878 0.1858 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6028 0.2366 0.0956 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3471 1.5105 -0.0163 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4998 -0.7042 0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7615 -1.9175 0.2344 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1912 -0.2957 0.0426 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8955 -1.2032 0.0721 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1939 -0.5312 -0.0329 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4269 0.8377 -0.1513 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7876 0.9976 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3150 -0.2732 -0.1376 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3443 -1.1292 -0.0309 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1446 -1.2441 0.4341 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4926 0.0878 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5175 0.4448 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1414 2.2218 -0.0417 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3391 1.8556 -0.0838 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8707 -1.7269 1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8083 -1.9849 -0.6892 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6870 1.6120 -0.1837 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3489 1.8937 -0.3117 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3853 -0.5000 -0.1619 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