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N,N-Dibutyl-3-oxobutanamide

HCID 243714
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Basic information

CAS
2235-47-4
Standard SMILES
CCCCN(CCCC)C(=O)CC(C)=O
InChIKey
QYIYWUBFHJEWPO-UHFFFAOYSA-N
Molecular formula
C12H23NO2
Average molar mass
213.32 g/mol
Monoisotopic mass
213.17287898

Names & identifiers

Preferred name
N,N-Dibutyl-3-oxobutanamide
IUPAC
N,N-dibutyl-3-oxobutanamide
English name
N,N-dibutyl-3-oxo-butanamide
Molecular formula
C12H23NO2
Molecular weight
0

Names & synonyms

n,n-dibutyl-3-oxobutanamide2235-47-4DTXSID80288026RefChem:358867DTXCID20239173N,N-DIBUTYL-3-OXO-BUTANAMIDENSC 53851NSC53851N,N-Di-n-butylacetoacetamidButanamide,n,n-dibutyl-3-oxo-SCHEMBL2417403QYIYWUBFHJEWPO-UHFFFAOYSA-N
Show more names
N,N-Dibutylacetoacetamide
NSC-53851SBB056670AKOS009258802DS-007302ST50979619

Database identifiers

CAS
2235-47-4
PubChem CID
243714
DTXSID
DTXSID80288026
Nikkaji
J393.208G

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
37.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
8
Heavy atoms
15
Formal charge
0
Complexity
194

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Related reactions

2 records
New reaction record
HRID 400204 reaction equation
HRID 400204As productuspto-grants-1998_10
HRID 824859 reaction equation
HRID 824859As productTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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