Cas no 156-12-7 (Benzeneethanamine,3,4-dichloro-a-methyl-, hydrochloride, (+)- (9CI))
156-12-7 structure
Product Name:Benzeneethanamine,3,4-dichloro-a-methyl-, hydrochloride, (+)- (9CI)
CAS No:156-12-7
MF:C9H12Cl3N
MW:240.557279586792
CID:237566
PubChem ID:201553
Update Time:2025-04-19
Benzeneethanamine,3,4-dichloro-a-methyl-, hydrochloride, (+)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzeneethanamine,3,4-dichloro-a-methyl-, hydrochloride, (+)- (9CI)
- 2-(3,4-dichloro-phenoxy)-ethanol
- 2-(3,4-dichloro-phenyl)-1-methyl-ethylamine, hydrochloride
- 2-(3,4-Dichlor-phenoxy)-aethanol
- 2-(3,4-Dichlor-phenyl)-1-methyl-aethylamin, Hydrochlorid
- CTK2A4092
- Ethanol, 2-(3,4-dichlorophenoxy)-
- SureCN9451250
- 2643-14-3
- dl-3,4-Dichloro-alpha-methylphenethylamine hydrochloride
- Phenethylamine, 3,4-dichloro-alpha-methyl-, hydrochloride, dl-
- dl-m,p-Dicloro-alpha-metilfenetilamina HCl
- 3,4-Dichloro-alpha-methylbenzeneethanamine hydrochloride
- 3,4-DICHLOROPHENYL-2-AMINOPROPANE HYDROCHLORIDE
- 6229-86-3
- Q17JEA2FRD
- 156-12-7
- BENZENEETHANAMINE, 3,4-DICHLORO-.ALPHA.-METHYL-, HYDROCHLORIDE (1:1)
- PHENETHYLAMINE, 3,4-DICHLORO-.ALPHA.-METHYL-, HYDROCHLORIDE
- UNII-Q17JEA2FRD
- DTXSID30949317
- Benzeneethanamine, 3,4-dichloro-alpha-methyl-, hydrochloride
- NSC-93734
- CHEMBL1987806
- NSC93734
- 1-(3,4-Dichlorophenyl)propan-2-amine--hydrogen chloride (1/1)
- dl-m,p-Dicloro-alpha-metilfenetilamina HCl [Italian]
-
- Inchi： 1S/C9H11Cl2N.ClH/c1-6(12)4-7-2-3-8(10)9(11)5-7;/h2-3,5-6H,4,12H2,1H3;1H
- InChI Key： OFHUVEDFQIRAKY-UHFFFAOYSA-N
- SMILES： ClC1=C(C=CC(=C1)CC(C)N)Cl.Cl
Computed Properties
- Exact Mass: 272.08309
- Monoisotopic Mass: 239.003532g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 141
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 52.54
Benzeneethanamine,3,4-dichloro-a-methyl-, hydrochloride, (+)- (9CI) Related Literature
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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