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
-0.8908 1.5743 0.5194 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2319 0.4529 0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6600 0.2932 -0.2297 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1027 -0.8383 -0.7186 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5903 1.4367 0.0521 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2534 -0.5182 -0.1604 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1211 -0.3837 0.1063 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6845 0.6596 0.7937 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0604 0.7081 0.9954 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9093 -0.2687 0.5254 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3628 -1.3271 -0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0251 -1.3685 -0.3613 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1798 -0.8850 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4556 -1.6541 -0.9222 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2429 1.9530 0.9791 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5853 2.1158 -0.8101 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5933 1.0149 0.2423 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5682 -1.4332 -0.5505 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1366 1.4742 1.2151 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5010 1.5527 1.5496 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9839 -0.2225 0.6879 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9746 -2.1343 -0.5679 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5948 -2.2018 -0.9080 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