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
1.1937 -1.4132 0.3829 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2982 -0.2072 -0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6437 0.3366 -0.2645 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8704 1.5591 -0.6692 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8196 -0.5487 -0.0524 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1276 0.5317 -0.1749 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2112 0.1175 0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5304 -1.0193 0.7345 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8456 -1.3841 0.9018 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8686 -0.6361 0.3942 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5482 0.5067 -0.2983 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2622 0.8980 -0.4836 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8657 1.9404 -0.8513 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0579 2.2402 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0080 -1.2220 -0.9114 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5911 -1.2237 0.8111 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7104 0.0337 0.2539 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2386 1.5397 -0.5054 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7943 -1.6565 1.1735 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0813 -2.2928 1.4532 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8878 -0.9747 0.5584 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3974 1.0856 -0.6935 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9979 1.7891 -1.0237 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