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Predicted properties of the compound entered.

ID SNPPWIUOZRMYNY-UHFFFAOYSA-N
Formula C13H18ClNO
IUPAC Name (2S)-2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,15H,1-4H3
Standard InChIKey (User Input) InChIKey=SNPPWIUOZRMYNY-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one | 34911-55-2 | 34841-39-9 | KBioGR_001168 | KBio1_001994 | Spectrum_001663 | 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one | CHEBI:3219 | SPBio_001817 | 1-Propanone, 1-(3-chlorophenyl)-2-[(1, 1-dimethylethyl)amino]- | KBio2_002143 | Prestwick3_000249 | AIDS-156243 | NCI60_002714 | Prestwick1_000249 | KBioSS_002143 | 2-(Tert-Butylamino)-3'-chloropropiophenone | DivK1c_007050 | Spectrum5_001406 | 1-(3-chlorophenyl)-2-[(1,1-dimethylethyl)amino]propan-1-one | BPBio1_000042 | Prestwick2_000249 | Spectrum3_000644 | BSPBio_002247 | Prestwick0_000249 | SPBio_002257 | KBio3_001467 | ( -)-2-(tert-Butylamino)-3'-chloropropiophenone | 1-Propanone, 1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)- | Bupropion (Old RN) | (+-)-Bupropion | 1-Propanone, 1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-, (+-)- | Amfebutamona [INN-Spanish] | Amfebutamone | Amfebutamonum [INN-Latin] | BRN 2101062 | alpha-(tert-Butylamino)-m-chloropropiophenone | Bupropion | C06860 | BSPBio_000038 | SpecPlus_000954 | Spectrum2_001659 | Bupropion (USAN) | (-)-2-(tert-butylamino)-3'-chloropropiophenone | 1-propanone, 1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-,(+-)- | CPD-3481 | amfebutamonum | 31677-93-7 (HYDROCHLORIDE) | KBio2_004711 | AIDS156243 | ( -)-2-(tert-Butylamino)-3'-chlorpropiophenon | NSC315851 (HYDROCHLORIDE) | Propiophenone, 2-(tert-butylamino)-3'-chloro- | Spectrum4_000614 | (+-)-1-(3-Chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone | Lopac0_000166 | KBio2_007279
Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -