Cas no 20157-46-4 (1H-Pyrazole, 3,5-dimethyl-1-(4-methylphenyl)-)
20157-46-4 structure
Product Name:1H-Pyrazole, 3,5-dimethyl-1-(4-methylphenyl)-
CAS No:20157-46-4
MF:C12H14N2
MW:186.252962589264
CID:1391648
PubChem ID:13637618
Update Time:2025-04-20
1H-Pyrazole, 3,5-dimethyl-1-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole, 3,5-dimethyl-1-(4-methylphenyl)-
- 3,5-dimethyl-1-(4-methylphenyl)pyrazole
- AKOS008956739
- SCHEMBL10169870
- DTXSID90545617
- 3,5-Dimethyl-1-(4-methylphenyl)-1H-pyrazole
- 20157-46-4
-
- Inchi: 1S/C12H14N2/c1-9-4-6-12(7-5-9)14-11(3)8-10(2)13-14/h4-8H,1-3H3
- InChI Key: PUQFJZIRTBUYPB-UHFFFAOYSA-N
- SMILES: N1(C2C=CC(C)=CC=2)C(C)=CC(C)=N1
Computed Properties
- Exact Mass: 186.11582
- Monoisotopic Mass: 186.115698455g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 185
- 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: 3.1
- Topological Polar Surface Area: 17.8?2
Experimental Properties
- PSA: 17.82
1H-Pyrazole, 3,5-dimethyl-1-(4-methylphenyl)- Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
20157-46-4 (1H-Pyrazole, 3,5-dimethyl-1-(4-methylphenyl)-) Related Products
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