2-(Hydroxymethyl)-2-methylbutanal

HCID 349094
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Basic information

CAS
1112-47-6
Standard SMILES
CCC(C)(C=O)CO
InChIKey
UCEILBKMJKUVFS-UHFFFAOYSA-N
Molecular formula
C6H12O2
Average molar mass
116.16 g/mol
Monoisotopic mass
116.08372962

Names & identifiers

Preferred name
2-(Hydroxymethyl)-2-methylbutanal
IUPAC
2-(hydroxymethyl)-2-methylbutanal

Names & synonyms

2-(hydroxymethyl)-2-methylbutanal1112-47-6DTXSID60325105RefChem:254141DTXCID40276222NSC408651NCIOpen2_003619SCHEMBL341697UCEILBKMJKUVFS-UHFFFAOYSA-N2-methyl-2-ethyl-3-hydroxypropanalNSC-4086512-ethyl-2-(hydroxy- methyl)- Propanal
Show more names
DS-007290BUTANAL,2-(HYDROXYMETHYL)-2-METHYL-EN300-112697

Database identifiers

CAS
1112-47-6
PubChem CID
349094
DTXSID
DTXSID60325105

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
8

Related reactions

1 records
New reaction record

Compound notes

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