2-Methyl-1-pentene

Details

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Internal ID 50e77580-72f9-4b33-97f6-2df1ba1271b2
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Branched unsaturated hydrocarbons
IUPAC Name 2-methylpent-1-ene
SMILES (Canonical) CCCC(=C)C
SMILES (Isomeric) CCCC(=C)C
InChI InChI=1S/C6H12/c1-4-5-6(2)3/h2,4-5H2,1,3H3
InChI Key WWUVJRULCWHUSA-UHFFFAOYSA-N
Popularity 200 references in papers

Physical and Chemical Properties

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Molecular Formula C6H12
Molecular Weight 84.16 g/mol
Exact Mass 84.093900383 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 3.00

Synonyms

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763-29-1
2-Methylpent-1-ene
2-Methylpentene
4-Methyl-4-pentene
1-Pentene, 2-methyl-
2-Methyl-pentene-1
OKC25O38MC
NSC-73908
EINECS 212-108-7
NSC 73908
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 2-Methyl-1-pentene

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL4040 P28482 MAP kinase ERK2 91.87% 83.82%
CHEMBL2581 P07339 Cathepsin D 90.36% 98.95%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 89.46% 96.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 80.13% 91.11%
CHEMBL1951 P21397 Monoamine oxidase A 80.04% 91.49%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Basella alba

Cross-Links

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PubChem 12986
LOTUS LTS0187258
wikiData Q27285703