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
-1.1192 -1.6591 0.3252 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4811 -0.4537 0.0535 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9092 -0.1708 -0.0924 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3536 1.0083 -0.3638 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8600 -1.3017 0.0838 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4847 0.5271 -0.0886 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9066 0.3179 0.0305 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7064 1.4597 0.2568 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0554 1.2550 0.3489 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6472 0.0140 0.2327 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8709 -1.0802 0.0146 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4739 -0.9187 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0256 -0.1392 0.3347 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7155 1.8501 -0.4992 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4290 1.1684 -0.4627 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3681 -2.2909 -0.0155 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6758 -1.1578 -0.6553 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2457 -1.2586 1.1412 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8232 1.5214 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2337 2.4383 0.3479 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6994 2.1110 0.5226 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2856 -2.0761 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9249 -1.8323 -0.2763 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6352 0.6681 0.4990 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