Propane

Details

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Internal ID 83f8114c-f1d8-4a99-9933-78146dc528c6
Taxonomy Hydrocarbons > Saturated hydrocarbons > Alkanes
IUPAC Name propane
SMILES (Canonical) CCC
SMILES (Isomeric) CCC
InChI InChI=1S/C3H8/c1-3-2/h3H2,1-2H3
InChI Key ATUOYWHBWRKTHZ-UHFFFAOYSA-N
Popularity 30,400 references in papers

Physical and Chemical Properties

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Molecular Formula C3H8
Molecular Weight 44.10 g/mol
Exact Mass 44.062600255 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 1.80

Synonyms

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n-Propane
Dimethylmethane
Propyl hydride
74-98-6
propan
Propyldihydride
Propane liquefied
A-108
Purifrigor p 3.5
HC 290
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Propane

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.05% 96.09%

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.
Dracaena cochinchinensis
Illicium difengpi
Leibnitzia anandria
Panax notoginseng
Plantago asiatica
Pyrola japonica
Trichosanthes rosthornii

Cross-Links

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PubChem 6334
NPASS NPC11651