CAS
943-80-3 Purity
96%
943-80-3 Purity
96%
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1-Propanone,3-(diethylamino)-1-phenyl-
CAS
94-38-2
Catalog Number
ACM94382
Category
Other Products
Molecular Weight
205.29606
Molecular Formula
C13H19NO
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Specification
Synonyms
3-(diethylamino)propiophenone;3-(diethylamino)-1-phenylpropan-1-one;1-Phenyl-3-(diethylamino)-1-propanone;3-(Diethylamino)-1-phenyl-1-propanone;3-(diethylamino)-1-phenylpropan-1-one HCl
IUPAC Name
3-(diethylamino)-1-phenylpropan-1-one
Canonical SMILES
CCN(CC)CCC(=O)C1=CC=CC=C1
InChI Key
YZTCGYARZGKANI-UHFFFAOYSA-N
Boiling Point
301.7ºC at 760 mmHg
Flash Point
101.4ºC
Density
0.974g/cm³
EC Number
202-329-7
Exact Mass
205.14700
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of the compound with PubChem CID 66749?
The molecular formula is C13H19NO.
What is the molecular weight of the compound?
The molecular weight is 205.30 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 3-(diethylamino)-1-phenylpropan-1-one.
What is the InChI of the compound?
The InChI is InChI=1S/C13H19NO/c1-3-14(4-2)11-10-13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3.
What is the InChIKey of the compound?
The InChIKey is YZTCGYARZGKANI-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES is CCN(CC)CCC(=O)C1=CC=CC=C1.
What is the CAS number of the compound?
The CAS number is 94-38-2.
What is the European Community (EC) number of the compound?
The European Community (EC) number is 202-329-7.
What is the ChEMBL ID of the compound?
The ChEMBL ID is CHEMBL130526.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 2.3.
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