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Substance
ID:1825923
Structure
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Functional Group
Text
ID:74508
heptan-2-one
Chemical Entities of Biological Interest
ID: CHEBI:5672
Names and Identifiers
IUPAC Traditional name
2-heptanone
IUPAC name
heptan-2-one
Synonyms
heptan-2-one
2-Heptanone
Heptan-2-one
Methyl n-amyl ketone
butylacetone
heptan-2-one
methyl pentyl ketone
n-amyl methyl ketone
n-pentyl methyl ketone
Registration numbers
CAS Number
110-43-0
Beilstein Number
1699063
PubChem CID
8051
Wikipedia Title
2-Heptanone
KEGG ID
C08380
KNApSAcK Database
C00001254
LIPID MAPS Instance
LMFA12000004
PubMed Citation Links
20416794
14759148
2270874
12769891
16025460
Reaxys Registry
1699063
ACToR Database
110-43-0
29299-43-2
BKMS React Database
125996
6737
BRENDA Database
1.1.1.1
1.1.1.71
3.7.1.7
1.1.1.183
1.1.1.2
1.1.3.18
1.1.1.268
2.6.1.18
1.1.9.1
1.4.3.12
1.1.2.9
1.1.1.B3
1.4.1.B6
1.1.1.184
1.14.13.92
4.1.2.10
1.1.1.B4
4.1.2.47
2.6.1.21
1.14.13.226
1.1.1.219
2.6.1.B16
BRENDA Ligand Database
125996
6737
CHEMBL
CHEMBL18893
CompTox Database
DTXSID5021916
MetaboLights Database
MTBLS4366
MTBLS2267
MTBLS673
MTBLS2406
MTBLS1267
MTBLS1737
MTBLS392
MTBLS2633
Protein Data Bank
3kfg
SABIO-RK Database
14264
10774
10747
10761
SureChEMBL Database
SCHEMBL29364
UniProt Database
Q9VVF3
P81913
Q9VHQ7
Q9VT20
Q9W5G6
Q9V568
Q9V6A9
Rhea Database
RHEA:54836
NMRShiftDB Database
30000764
Patent number
EP1336609
WO2005070931
WO2005021515
WO2005058820
BindingDB Database
50028842
Gmelin ID
305860
CHEBI ID
CHEBI:5672
PubChem SID
11533299
Properties
No Data Available
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Molecule Details
A dialkyl ketone with methyl and pentyl as the alkyl groups.
Molecular Spectra
No Data Available
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References
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