Cas no 87871-09-8 (1H-Imidazo[4,5-c]pyridine-1-ethanol,4-amino-b-hexyl-a-methyl-, (aR,bS)-rel-)
87871-09-8 structure
Product Name:1H-Imidazo[4,5-c]pyridine-1-ethanol,4-amino-b-hexyl-a-methyl-, (aR,bS)-rel-
CAS No:87871-09-8
MF:C15H24N4O
MW:276.377263069153
CID:723578
PubChem ID:3036121
Update Time:2025-04-19
1H-Imidazo[4,5-c]pyridine-1-ethanol,4-amino-b-hexyl-a-methyl-, (aR,bS)-rel- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazo[4,5-c]pyridine-1-ethanol,4-amino-b-hexyl-a-methyl-, (aR,bS)-rel-
- (2R,3S)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)nonan-2-ol
- 9-(2-hydroxy-3-nonyl)-3-deazaadenine
- 3-Deaza-ehna
- 9FRF2ZJ35M
- 4-Amino-1-(2-hydroxy-3-nonyl)-1H-imidazo(4,5-c)pyridine
- 9-(2-HYDROXY-3-NONYL)-3-DEAZAADENINE, ERYTHRO-
- (2R,3S)-3-(4-Amino-1H-imidazo(4,5-c)pyridin-1-yl)-2-nonanol
- Q27272496
- 1H-IMIDAZO(4,5-C)PYRIDINE-1-ETHANOL, 4-AMINO-.BETA.-HEXYL-.ALPHA.-METHYL-, (R*,S*)-
- erythro-9-(2-Hydroxy-3-nonyl)-3-deazaadenine
- HWC-09
- 1H-IMIDAZO(4,5-C)PYRIDINE-1-ETHANOL, 4-AMINO-.BETA.-HEXYL-.ALPHA.-METHYL-, (.ALPHA.R,.BETA.S)-REL-
- 87871-09-8
- UNII-9FRF2ZJ35M
- DTXSID90236674
- 1H-Imidazo(4,5-c)pyridine-1-ethanol, 4-amino-beta-hexyl-alpha-methyl-, (R*,S*)-(+-)-
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- Inchi: 1S/C15H24N4O/c1-3-4-5-6-7-12(11(2)20)19-10-18-14-13(19)8-9-17-15(14)16/h8-12,20H,3-7H2,1-2H3,(H2,16,17)/t11-,12+/m1/s1
- InChI Key: DAWSASDELFSMFB-NEPJUHHUSA-N
- SMILES: O[C@H](C)[C@H](CCCCCC)N1C=NC2C(N)=NC=CC1=2
Computed Properties
- Exact Mass: 276.195011
- Monoisotopic Mass: 276.195011
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 289
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 77
- XLogP3: 2.6
Experimental Properties
- Density: 1.2
- Boiling Point: 477.3°C at 760 mmHg
- Flash Point: 242.5°C
- Refractive Index: 1.604
1H-Imidazo[4,5-c]pyridine-1-ethanol,4-amino-b-hexyl-a-methyl-, (aR,bS)-rel- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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