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
-0.9766 1.8719 -0.5187 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4107 0.7827 -0.0927 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8629 0.6805 0.0293 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6091 1.7019 -0.3031 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4288 -0.5959 0.5318 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5997 -0.3164 0.2645 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8007 -0.2726 0.1747 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4734 -1.5076 0.2175 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8324 -1.5841 0.1574 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5707 -0.4377 0.0528 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9241 0.7611 0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5325 0.8643 0.0716 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9444 -0.4671 -0.0111 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1509 2.6093 -0.6636 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6879 1.6847 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0338 -0.7325 1.5718 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0113 -1.4043 -0.1143 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5265 -0.6028 0.5338 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0875 -1.2044 0.6162 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8954 -2.4183 0.3001 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3590 -2.5433 0.1904 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4918 1.7002 -0.0725 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0912 1.8551 0.0455 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4702 -0.4248 0.8385 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