Cas no 713482-84-9 (1H-Pyrazole-1-ethanamine,N,N,3,5-tetramethyl-)
713482-84-9 structure
Product Name:1H-Pyrazole-1-ethanamine,N,N,3,5-tetramethyl-
CAS No:713482-84-9
MF:C9H17N3
MW:167.251381635666
CID:558059
PubChem ID:45088950
Update Time:2025-04-19
1H-Pyrazole-1-ethanamine,N,N,3,5-tetramethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole-1-ethanamine,N,N,3,5-tetramethyl-
- 1H-Pyrazole-1-ethanamine,N,N,3,5-tetramethyl-(9CI)
- 2-(3,5-Dimethyl-1H-pyrazol-1-yl)-N,N-dimethylethanamine
- 713482-84-9
- SCHEMBL12102940
-
- Inchi： 1S/C9H17N3/c1-8-7-9(2)12(10-8)6-5-11(3)4/h7H,5-6H2,1-4H3
- InChI Key： DODZTAMGNBTTRI-UHFFFAOYSA-N
- SMILES： N1(C(C)=CC(C)=N1)CCN(C)C
Computed Properties
- Exact Mass: 167.14241
- Monoisotopic Mass: 167.142
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 136
- 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
- Topological Polar Surface Area: 21.1A^2
- XLogP3: 1
Experimental Properties
- PSA: 21.06
1H-Pyrazole-1-ethanamine,N,N,3,5-tetramethyl- Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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