Monomers
Methyl 2-(propoxymethyl)prop-2-enoate
Identifiers
IUPAC name
methyl 2-(propoxymethyl)prop-2-enoate
InchI
InChI=1S/C8H14O3/c1-4-5-11-6-7(2)8(9)10-3/h2,4-6H2,1,3H3
InchI Key
OVZWLGCWEYISAY-UHFFFAOYSA-N
SMILES
CCCOCC(=C)C(=O)OC
Canonical SMILES
CCCOCC(=C)C(=O)OC
Isomeric SMILES
CCCOCC(=C)C(=O)OC
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H14O3
Heavy Atom Count
11
Molecular Weight
158.197
Exact Molecular Weight
158.0943
Valence Electrons
64
Radical Electrons
0
tPSA
35.53
MolLogP
1.1422
H Bond Acceptors
3
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
25 24 0 0 0 0 0 0 0 0999 V2000
2.7787 -0.1745 2.0402 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3755 -0.2739 0.5827 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2441 0.6770 0.3487 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7672 0.6989 -0.9378 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2782 -0.5010 -1.3992 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8409 -0.9426 -0.5459 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7752 -2.0815 0.0962 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0153 -0.1091 -0.4213 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0000 -0.4647 0.3098 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1626 1.1081 -1.0671 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3239 1.9085 -0.9297 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3133 0.6680 2.5618 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8863 -0.0453 2.1471 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5372 -1.1043 2.6016 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0745 -1.3127 0.3991 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2435 0.0534 -0.0189 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4007 0.4770 1.0413 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6031 1.6982 0.5915 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1505 -0.3085 -2.4143 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0500 -1.2786 -1.5369 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0803 -2.7477 0.0405 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5916 -2.4069 0.7206 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0937 1.4333 -0.2936 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9713 2.8785 -0.4802 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7074 2.1504 -1.9311 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 1 0
6 7 2 3
6 8 1 0
8 9 2 0
8 10 1 0
10 11 1 0
1 12 1 0
1 13 1 0
1 14 1 0
2 15 1 0
2 16 1 0
3 17 1 0
3 18 1 0
5 19 1 0
5 20 1 0
7 21 1 0
7 22 1 0
11 23 1 0
11 24 1 0
11 25 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers