Cas no 951400-09-2 (2C-I-d6)
2C-I-d6 structure
Product Name:2C-I-d6
CAS No:951400-09-2
MF:C10H15ClINO2
MW:349.626044511795
CID:1001454
PubChem ID:46781361
Update Time:2025-04-20
2C-I-d6 Chemical and Physical Properties
Names and Identifiers
-
- 2C-I-d6
- 2,5-(Dimethoxy-d6)-4-iodophenethylamine Hydrochloride
- 2,4-DICHLORO-4'-THIOMORPHOLINOMETHYL BENZOPHENONE
- 4-Iodo-2,5-di(methoxy-d3)benzeneethanamine Hydrochloride
- 2C-I-D6.HCl, 1mg/ml in Methanol
- 2C-I-D6.HCl, 0.1mg/ml in Methanol
- 1216685-82-3
- 2-[4-iodo-2,5-bis(trideuteriomethoxy)phenyl]ethanamine;hydrochloride
- 951400-09-2
- 2C-I-D6.HCl
-
- Inchi： 1S/C10H14INO2.ClH/c1-13-9-6-8(11)10(14-2)5-7(9)3-4-12;/h5-6H,3-4,12H2,1-2H3;1H/i1D3,2D3;
- InChI Key： OTUXWIRPEPMONF-TXHXQZCNSA-N
- SMILES： IC1=CC(=C(C=C1OC([2H])([2H])[2H])CCN)OC([2H])([2H])[2H].Cl
Computed Properties
- Exact Mass: 349.02100
- Monoisotopic Mass: 349.02126g/mol
- Isotope Atom Count: 6
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 168
- 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: 44.5?2
Experimental Properties
- Melting Point: 227-231°C
- PSA: 44.48000
- LogP: 3.31190
2C-I-d6 Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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3. 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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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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