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(2R)-2,3-Dimethylbutanal

HCID 5289546
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Basic information

CAS
49642-48-0
Standard SMILES
CC(C)[C@@H](C)C=O
InChIKey
AKUUEDVRXOZTBF-LURJTMIESA-N
Molecular formula
C6H12O
Average molar mass
100.16 g/mol
Monoisotopic mass
100.088815

Names & identifiers

Preferred name
(2R)-2,3-Dimethylbutanal
IUPAC
(2R)-2,3-dimethylbutanal

Names & synonyms

(2R)-2,3-Dimethylbutanal49642-48-0RefChem:206583AKUUEDVRXOZTBF-LURJTMIESA-NDTXSID301313396

Database identifiers

CAS
49642-48-0
PubChem CID
5289546
DTXSID
DTXSID301313396
Nikkaji
J52.850A

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
7
Formal charge
0
Complexity
57.2

Related reactions

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Compound notes

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