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
1.0459 -1.5566 -0.6027 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2592 -0.3427 -0.3934 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6697 0.1132 -0.4072 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0327 1.3536 -0.2034 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7424 -0.9020 -0.6693 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1892 0.5353 -0.1569 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1704 0.1797 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0969 1.2053 0.1259 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4526 0.9956 0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9342 -0.2728 -0.0195 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0744 -1.3125 -0.2714 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7162 -1.0516 -0.3176 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3602 2.1563 -0.0085 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0897 1.5979 -0.2318 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6460 -0.4634 -1.0925 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3635 -1.7233 -1.3219 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9615 -1.3829 0.3141 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4827 1.5475 0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7387 2.2087 0.2864 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1255 1.8253 0.3816 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9990 -0.4877 0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4420 -2.3390 -0.4355 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0927 -1.8840 -0.5148 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