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
1.7576 0.4743 0.0198 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7447 -0.4758 -0.5517 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6022 -0.3259 0.0393 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1955 -1.3163 0.6672 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3259 0.9601 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3647 1.0663 0.8818 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6723 -0.0641 0.4054 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1251 1.1945 -0.7458 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7261 -0.3125 -1.6691 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0985 -1.5347 -0.4407 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6762 -2.2680 0.7502 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1655 -1.2124 1.0943 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8940 1.1932 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6027 1.7645 -0.3227 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0270 0.8568 -0.9367 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