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
1.0192 1.7450 -0.4095 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4234 0.5605 -0.0922 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8352 0.3093 0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3080 -0.8577 0.3852 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7866 1.4294 -0.1407 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5043 -0.4926 0.1014 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8984 -0.3219 -0.0263 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6041 -1.4838 -0.3215 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9670 -1.4048 -0.4355 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6089 -0.1987 -0.2597 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8922 0.9415 0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4914 0.8909 0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9936 -0.0961 -0.3715 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7562 -1.7711 0.5702 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3993 -1.0160 0.4995 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7755 1.0351 -0.4628 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9123 2.0388 0.7814 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3427 2.1057 -0.9034 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8855 -1.4668 0.3607 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0772 -2.4418 -0.4598 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5695 -2.2824 -0.6651 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3532 1.8998 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9691 1.8161 0.4049 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5238 -0.9384 -0.5876 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