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
0.9730 -1.5212 0.6071 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2206 -0.3332 0.2253 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6632 -0.0107 0.2005 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0556 1.1777 -0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6861 -1.0267 0.5977 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2144 0.5577 -0.1292 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1639 0.2552 -0.0978 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0564 1.0586 -0.8442 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4053 0.8596 -0.8603 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9203 -0.1761 -0.1113 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0689 -0.9690 0.6221 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6770 -0.7701 0.6442 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1092 1.4647 -0.2084 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3678 1.9390 -0.4661 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2580 -1.2950 -0.3056 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1350 -1.9248 0.9615 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3339 -0.6513 1.4195 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4649 1.5325 -0.4455 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6325 1.8743 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0639 1.5089 -1.4555 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9886 -0.3482 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4410 -1.7913 1.2215 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0641 -1.4104 1.2445 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