CHEBI:30358 - neopentane

Main ChEBI Ontology Automatic Xrefs
ChEBI Name neopentane
ChEBI ID CHEBI:30358
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C5H12
Net Charge 0
Average Mass 72.14878
InChI InChI=1S/C5H12/c1-5(2,3)4/h1-4H3
InChIKey CRSOQBOWXPBRES-UHFFFAOYSA-N
SMILES CC(C)(C)C
ChEBI Ontology
Outgoing neopentane (CHEBI:30358) is a alkane (CHEBI:18310)
Incoming neopentyl group (CHEBI:30357) is substituent group from neopentane (CHEBI:30358)
IUPAC Names
2,2-dimethylpropane
neopentane
Synonym Source
(CH3)4C IUPAC
Registry Numbers Types Sources
1730722 Beilstein Registry Number Beilstein
1850 Gmelin Registry Number Gmelin
463-82-1 CAS Registry Number NIST Chemistry WebBook
463-82-1 CAS Registry Number ChemIDplus
Last Modified
14 March 2007