Monomers
2-Hydroxypropyl methacrylate
Identifiers
IUPAC name
2-hydroxypropyl 2-methylprop-2-enoate
InchI
InChI=1S/C7H12O3/c1-5(2)7(9)10-4-6(3)8/h6,8H,1,4H2,2-3H3
InchI Key
VHSHLMUCYSAUQU-UHFFFAOYSA-N
SMILES
CC(COC(=O)C(=C)C)O
Canonical SMILES
CC(COC(=O)C(=C)C)O
Isomeric SMILES
CC(COC(=O)C(=C)C)O
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H12O3
Heavy Atom Count
10
Molecular Weight
144.17
Exact Molecular Weight
144.0786
Valence Electrons
58
Radical Electrons
0
tPSA
46.53
MolLogP
0.4865
H Bond Acceptors
3
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
22 21 0 0 0 0 0 0 0 0999 V2000
3.4875 -0.0025 0.4239 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0347 0.2360 -0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1774 -0.2292 1.1177 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1740 0.0057 0.9929 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0083 -0.4608 0.0037 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4644 -1.1776 -0.8742 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4431 -0.1474 -0.0335 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0104 0.6071 0.8925 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3265 -0.6610 -1.1104 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9357 1.6215 -0.2242 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1908 0.2869 -0.3824 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6268 -1.0335 0.7749 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6467 0.7463 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9074 -0.3298 -0.9443 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5434 0.2898 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3610 -1.2988 1.2696 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0423 0.8530 0.8964 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3807 0.9991 1.6988 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1739 -1.2524 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8290 0.2155 -1.6122 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7720 -1.2533 -1.8565 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7133 1.9855 -0.6933 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 1 0
5 6 2 0
5 7 1 0
7 8 2 3
7 9 1 0
2 10 1 0
1 11 1 0
1 12 1 0
1 13 1 0
2 14 1 0
3 15 1 0
3 16 1 0
8 17 1 0
8 18 1 0
9 19 1 0
9 20 1 0
9 21 1 0
10 22 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers