Monomers
2-Methyl-1-butene
Identifiers
IUPAC name
2-methylbut-1-ene
InchI
InChI=1S/C5H10/c1-4-5(2)3/h2,4H2,1,3H3
InchI Key
MHNNAWXXUZQSNM-UHFFFAOYSA-N
SMILES
CCC(=C)C
Canonical SMILES
CCC(=C)C
Isomeric SMILES
CCC(=C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H10
Heavy Atom Count
5
Molecular Weight
70.135
Exact Molecular Weight
70.0783
Valence Electrons
30
Radical Electrons
0
tPSA
0.0
MolLogP
1.9725
H Bond Acceptors
0
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
15 14 0 0 0 0 0 0 0 0999 V2000
1.6973 -0.5796 -0.0125 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7632 0.5238 -0.4562 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5942 0.3693 0.0903 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1049 1.3083 0.8525 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3319 -0.8804 -0.2633 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3298 -1.5858 -0.2707 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7740 -0.5318 1.0891 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6739 -0.4525 -0.5141 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6702 0.5634 -1.5669 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1788 1.4814 -0.1093 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5403 2.1849 1.0785 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0929 1.1883 1.2461 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1353 -1.0730 -1.3441 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8744 -1.7213 0.3155 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4133 -0.7949 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 3
3 5 1 0
1 6 1 0
1 7 1 0
1 8 1 0
2 9 1 0
2 10 1 0
4 11 1 0
4 12 1 0
5 13 1 0
5 14 1 0
5 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers