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Home Other Building Blocks 1,3,5-Trimethyl-1H-pyrazole

1,3,5-Trimethyl-1H-pyrazole

CAS No.:
1072-91-9
Catalog Number:
AG003DGO
Molecular Formula:
C6H10N2
Molecular Weight:
110.1570
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$60
- +
100g
98%
In Stock USA
United States
$149
- +
500g
98%
In Stock USA
United States
$550
- +
Product Description
Catalog Number:
AG003DGO
Chemical Name:
1,3,5-Trimethyl-1H-pyrazole
CAS Number:
1072-91-9
Molecular Formula:
C6H10N2
Molecular Weight:
110.1570
MDL Number:
MFCD00015536
IUPAC Name:
1,3,5-trimethylpyrazole
InChI:
InChI=1S/C6H10N2/c1-5-4-6(2)8(3)7-5/h4H,1-3H3
InChI Key:
HNOQAFMOBRWDKQ-UHFFFAOYSA-N
SMILES:
Cc1cc(n(n1)C)C
UNII:
63938V7Z82
Properties
Complexity:
82.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.084g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.16g/mol
Monoisotopic Mass:
110.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
A theoretical insight into the reaction mechanism of photochemical transposition from pyrazole to imidazole. The journal of physical chemistry. A 20081016
Dichloro[(3,5-dimethyl-1H-pyrazol-1-yl)methane]zinc(II) and di-mu-chloro-bis{chloro[(3,5-dimethyl-1H-pyrazol-1-yl)methane]cadmium(II)}. Acta crystallographica. Section C, Crystal structure communications 20060201
Properties