Cas no 245757-84-0 (Pyrazine,3-methoxy-2-methyl-5-(1-methylethyl)-)
245757-84-0 structure
Product Name:Pyrazine,3-methoxy-2-methyl-5-(1-methylethyl)-
CAS No:245757-84-0
MF:C9H14N2O
MW:166.220262050629
CID:245984
PubChem ID:12051522
Update Time:2025-04-19
Pyrazine,3-methoxy-2-methyl-5-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrazine,3-methoxy-2-methyl-5-(1-methylethyl)-
- Pyrazine, 3-methoxy-2-methyl-5-(1-methylethyl)- (9CI)
- 5-isopropyl-3-methoxy-2-methylpyrazine
- SCHEMBL9606634
- 3-methoxy-2-methyl-5-propan-2-ylpyrazine
- 245757-84-0
-
- Inchi： 1S/C9H14N2O/c1-6(2)8-5-10-7(3)9(11-8)12-4/h5-6H,1-4H3
- InChI Key： XAODRCOHPUSQSU-UHFFFAOYSA-N
- SMILES： O(C)C1=C(C)N=CC(C(C)C)=N1
Computed Properties
- Exact Mass: 166.11100
- Monoisotopic Mass: 166.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 139
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 35?2
Experimental Properties
- PSA: 35.01000
- LogP: 1.91700
Pyrazine,3-methoxy-2-methyl-5-(1-methylethyl)- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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3. Exclusive enantioselective recognition of glucopyranosides by inherently chiral hemicryptophanes?Olivier Perraud,Alexandre Martinez,Jean-Pierre Dutasta Chem. Commun., 2011,47, 5861-5863
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
245757-84-0 (Pyrazine,3-methoxy-2-methyl-5-(1-methylethyl)-) Related Products
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