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
1.3385 -1.4717 -0.2843 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5132 -0.2901 0.1038 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8761 0.0919 0.4142 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1746 1.2905 0.8252 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9428 -0.9572 0.2426 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4427 0.6134 0.2301 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8970 0.2687 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8289 1.2909 -0.2305 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1590 1.0719 -0.4939 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6253 -0.2198 -0.5988 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7402 -1.2492 -0.4354 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3788 -1.0001 -0.1652 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9500 -0.4663 -0.8618 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4426 2.0431 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2135 1.5355 1.0476 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9331 -0.4788 0.1582 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8990 -1.6701 1.0954 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6743 -1.5040 -0.6871 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6193 1.6235 0.5641 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4763 2.3036 -0.1517 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8708 1.8725 -0.6255 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0599 -2.2841 -0.5088 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7574 -1.8558 -0.0392 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3262 -0.5584 -1.8100 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