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
Resources
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
-1.8941 0.0431 0.3247 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7051 0.5216 -0.4605 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5643 -0.0915 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6359 -0.9603 0.9921 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8198 0.3003 -0.6965 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7600 0.1446 1.4197 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7667 0.6768 0.0365 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1638 -1.0002 0.0468 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6459 1.6228 -0.4409 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8706 0.2131 -1.5191 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5702 -1.3889 1.3056 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2685 -1.2444 1.4968 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3328 1.0443 -0.0366 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5177 -0.5675 -0.7557 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6341 0.6863 -1.7142 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