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
-1.2106 -1.4311 -1.0469 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5206 -0.4261 -0.3891 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9497 -0.0766 -0.3036 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8415 -0.8168 -0.9107 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3925 1.1003 0.4591 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5322 0.3366 0.2428 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8605 0.0896 0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4634 -1.0195 -0.2828 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8574 -1.1696 -0.2602 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6803 -0.2146 0.2743 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0766 0.9092 0.7933 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7285 1.0584 0.7733 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0380 -0.4083 0.2726 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8829 -0.5704 -0.8542 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5229 -1.6744 -1.4671 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4576 0.9506 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8321 1.2463 1.4158 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3554 2.0409 -0.1612 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8994 1.1918 0.7882 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8673 -1.8160 -0.7146 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2579 -2.0674 -0.6805 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7292 1.6669 1.2175 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2802 1.9602 1.1923 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5580 -0.8601 1.0130 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