Monomers
N-(4-Hydroxyphenyl)methacrylamide
Identifiers
IUPAC name
N-(4-hydroxyphenyl)-2-methylprop-2-enamide
InchI
InChI=1S/C10H11NO2/c1-7(2)10(13)11-8-3-5-9(12)6-4-8/h3-6,12H,1H2,2H3,(H,11,13)
InchI Key
XZSZONUJSGDIFI-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)Nc1ccc(cc1)O
Canonical SMILES
CC(=C)C(=O)NC1=CC=C(C=C1)O
Isomeric SMILES
CC(=C)C(=O)NC1=CC=C(C=C1)O
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H11NO2
Heavy Atom Count
13
Molecular Weight
177.203
Exact Molecular Weight
177.079
Valence Electrons
68
Radical Electrons
0
tPSA
49.33
MolLogP
1.9068
H Bond Acceptors
2
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
24 24 0 0 0 0 0 0 0 0999 V2000
-1.3131 1.3935 0.3310 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5315 0.2249 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9392 -0.1447 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2836 -1.3215 -0.6307 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0210 0.8402 0.1569 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4393 -0.5903 -0.3938 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9290 -0.2540 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4226 0.8673 0.3031 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8002 1.1434 0.3692 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7182 0.2708 -0.1654 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2346 -0.8730 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8916 -1.1318 -0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0844 0.5094 -0.1191 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5574 -2.0557 -0.9027 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3362 -1.5635 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6287 1.8653 0.1258 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8739 0.7496 -0.5669 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4149 0.5578 1.1502 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6896 -1.5749 -0.7488 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7745 1.5985 0.7526 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1307 2.0482 0.8444 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9849 -1.5496 -1.1789 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5362 -2.0326 -1.2926 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5217 1.0226 -0.8849 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 3
3 5 1 0
2 6 1 0
6 7 1 0
7 8 2 0
8 9 1 0
9 10 2 0
10 11 1 0
11 12 2 0
10 13 1 0
12 7 1 0
4 14 1 0
4 15 1 0
5 16 1 0
5 17 1 0
5 18 1 0
6 19 1 0
8 20 1 0
9 21 1 0
11 22 1 0
12 23 1 0
13 24 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers