Cas no 99740-06-4 (2-Propanol,1-[(1-methylethyl)amino]-3-[2-(1H-pyrrol-1-yl)phenoxy]-, hydrochloride (1:1))
![2-Propanol,1-[(1-methylethyl)amino]-3-[2-(1H-pyrrol-1-yl)phenoxy]-, hydrochloride (1:1) structure](https://ossimg.kuujia.com/scimg/100000/99740-06-4x500.png)
99740-06-4 structure
Product Name:2-Propanol,1-[(1-methylethyl)amino]-3-[2-(1H-pyrrol-1-yl)phenoxy]-, hydrochloride (1:1)
CAS No:99740-06-4
MF:C16H23ClN2O2
MW:310.819023370743
CID:805286
PubChem ID:127403
Update Time:2025-04-19
2-Propanol,1-[(1-methylethyl)amino]-3-[2-(1H-pyrrol-1-yl)phenoxy]-, hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanol,1-[(1-methylethyl)amino]-3-[2-(1H-pyrrol-1-yl)phenoxy]-, hydrochloride (1:1)
- isamoltane
- 2-Propanol, 1-((1-methylethyl)amino)-3-(2-(1H-pyrrol-1-yl)phenoxy)-, hydrochloride
- CGP-361A
- Cgp 361A
- 2-PROPANOL, 1-((1-METHYLETHYL)AMINO)-3-(2-(1H-PYRROL-1-YL)PHENOXY)-, HYDROCHLORIDE (1:1)
- 1-(propan-2-ylamino)-3-(2-pyrrol-1-ylphenoxy)propan-2-ol;hydrochloride
- UNII-214SP5P1EX
- Q6078756
- 99740-06-4
- 1-(2-(1-Pyrrolyl)phenoxy)-3-isopropylamine-2-propanol hcl
- ISAMOLTAN HYDROCHLORIDE
- 1-[(Propan-2-yl)amino]-3-[2-(1H-pyrrol-1-yl)phenoxy]propan-2-olato--hydrogen chlorido (1/1)
- SCHEMBL10697990
- 214SP5P1EX
- DTXSID00912513
- 55050-96-9
- 2-Propanol, 1-((1-methylethyl)amino)-3-(2-(1H-pyrrol-1-yl)phenoxy)-, monohydrochloride
-
- Inchi： 1S/C16H22N2O2.ClH/c1-13(2)17-11-14(19)12-20-16-8-4-3-7-15(16)18-9-5-6-10-18;/h3-10,13-14,17,19H,11-12H2,1-2H3;1H
- InChI Key： DCOXRJZVVPMXLY-UHFFFAOYSA-N
- SMILES： Cl.O(C1C=CC=CC=1N1C=CC=C1)CC(CNC(C)C)O
Computed Properties
- Exact Mass: 310.1448057g/mol
- Monoisotopic Mass: 310.1448057g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 7
- Complexity: 267
- 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: 46.4?2
2-Propanol,1-[(1-methylethyl)amino]-3-[2-(1H-pyrrol-1-yl)phenoxy]-, hydrochloride (1:1) Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
99740-06-4 (2-Propanol,1-[(1-methylethyl)amino]-3-[2-(1H-pyrrol-1-yl)phenoxy]-, hydrochloride (1:1)) Related Products
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