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
-1.3522 -1.6759 -0.3746 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5795 -0.4993 -0.0608 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9780 -0.0205 -0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9251 -0.8655 -0.3236 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3075 1.3678 0.3452 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5074 0.3676 0.2549 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8627 0.0311 0.2517 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7763 0.9921 0.7111 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1275 0.7911 0.7518 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6616 -0.4000 0.3302 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8054 -1.3684 -0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4198 -1.1442 -0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0322 -0.6215 0.3647 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7400 -1.9060 -0.6026 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9493 -0.5567 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6881 1.7082 1.2265 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1734 2.0898 -0.4892 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3643 1.4336 0.7369 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8110 1.3652 0.5127 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3378 1.9358 1.0445 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7786 1.5782 1.1195 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2100 -2.3178 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7912 -1.9212 -0.5279 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5725 -0.3636 -0.4696 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