Monomers
N-Phenylmethacrylamide
Identifiers
IUPAC name
2-methyl-N-phenylprop-2-enamide
InchI
InChI=1S/C10H11NO/c1-8(2)10(12)11-9-6-4-3-5-7-9/h3-7H,1H2,2H3,(H,11,12)
InchI Key
IJSVVICYGLOZHA-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)Nc1ccccc1
Canonical SMILES
CC(=C)C(=O)NC1=CC=CC=C1
Isomeric SMILES
CC(=C)C(=O)NC1=CC=CC=C1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H11NO
Heavy Atom Count
12
Molecular Weight
161.204
Exact Molecular Weight
161.0841
Valence Electrons
62
Radical Electrons
0
tPSA
29.1
MolLogP
2.2012
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
23 23 0 0 0 0 0 0 0 0999 V2000
-0.9304 -1.6019 -0.6366 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2141 -0.4142 -0.3823 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6420 -0.0819 -0.3068 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1280 1.0966 -0.0538 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6051 -1.2102 -0.5444 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2312 0.5697 -0.1755 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1362 0.3022 -0.2418 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7142 -0.8430 -0.7048 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0978 -1.0208 -0.7176 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9063 -0.0368 -0.2606 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3689 1.1273 0.2118 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0098 1.2931 0.2209 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4886 1.9316 0.1223 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1990 1.2871 -0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1757 -1.3522 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2742 -0.8829 -1.3607 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1093 -2.1344 -0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5511 1.5755 0.0402 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1656 -1.6678 -1.0922 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5237 -1.9488 -1.0943 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0006 -0.1615 -0.2639 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0047 1.9359 0.5859 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6209 2.2375 0.6064 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
12 7 1 0
4 13 1 0
4 14 1 0
5 15 1 0
5 16 1 0
5 17 1 0
6 18 1 0
8 19 1 0
9 20 1 0
10 21 1 0
11 22 1 0
12 23 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers