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
-1.2636 1.4455 0.6931 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5304 0.3967 0.0632 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9235 0.1401 -0.2711 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3019 -0.9337 -0.9303 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9457 1.1266 0.1486 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4675 -0.4507 -0.2723 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9086 -0.2989 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8017 -1.2898 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1504 -1.2168 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6930 -0.1578 0.4582 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8695 0.8458 0.9074 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4976 0.7431 0.6632 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0538 -0.0183 0.7215 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3706 -1.0802 -1.1582 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6626 -1.7159 -1.2864 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5125 0.8110 1.0434 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5044 2.1242 0.3764 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6912 1.2554 -0.6877 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7600 -1.3241 -0.8065 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3779 -2.1321 -0.9612 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8318 -1.9962 -0.5512 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2682 1.7136 1.4471 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8751 1.5430 1.0256 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6063 0.4694 0.0172 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