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
1.4459 -0.1331 1.1113 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3911 0.8120 0.5876 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4500 0.1663 -0.4469 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4680 0.7085 -1.6539 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2549 -1.0350 -0.1937 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2894 -1.1763 0.7346 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4694 0.1477 0.7923 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4446 -0.0879 2.2224 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9003 1.6990 0.2084 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2994 1.1538 1.3912 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1065 1.5869 -1.8798 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0688 0.2833 -2.4696 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3567 -0.8652 -0.3542 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1618 -1.4023 0.8501 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9876 -1.8577 -0.8995 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