Cas no 13062-99-2 (Benzeneethanamine,2,4-dimethoxy-N-methyl-, hydrochloride (1:1))
13062-99-2 structure
Product Name:Benzeneethanamine,2,4-dimethoxy-N-methyl-, hydrochloride (1:1)
CAS No:13062-99-2
MF:C11H18ClNO2
MW:231.719122409821
CID:197493
PubChem ID:202630
Update Time:2025-04-19
Benzeneethanamine,2,4-dimethoxy-N-methyl-, hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Benzeneethanamine,2,4-dimethoxy-N-methyl-, hydrochloride (1:1)
- 2-(2,4-dimethoxyphenyl)-N-methylethanamine,hydrochloride
- 13062-99-2
- DTXSID30156645
- 2,4-Dimethoxy-beta-phenylethylmethylamine hydrochloride
- 2,4-Dimethoxy-N-methylphenethylamine hydrochloride
- Phenethylamine, 2,4-dimethoxy-N-methyl-, hydrochloride
-
- Inchi： 1S/C11H17NO2.ClH/c1-12-7-6-9-4-5-10(13-2)8-11(9)14-3;/h4-5,8,12H,6-7H2,1-3H3;1H
- InChI Key： PCNMEXMWDBACEZ-UHFFFAOYSA-N
- SMILES： Cl.O(C)C1C=C(C=CC=1CCNC)OC
Computed Properties
- Exact Mass: 231.10274
- Monoisotopic Mass: 231.103
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 152
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 30.5?2
Experimental Properties
- Boiling Point: 289°Cat760mmHg
- Flash Point: 117.5°C
- PSA: 30.49
Benzeneethanamine,2,4-dimethoxy-N-methyl-, hydrochloride (1:1) Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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