sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 4-(3-Hydroxypropyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole

4-(3-Hydroxypropyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole

CAS No.:
1864052-96-9
Catalog Number:
AG00IKDF
Molecular Formula:
C8H11F3N2O
Molecular Weight:
208.1809
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$250
- +
5g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00IKDF
Chemical Name:
4-(3-Hydroxypropyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole
CAS Number:
1864052-96-9
Molecular Formula:
C8H11F3N2O
Molecular Weight:
208.1809
MDL Number:
MFCD29127296
IUPAC Name:
3-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]propan-1-ol
InChI:
InChI=1S/C8H11F3N2O/c1-13-5-6(3-2-4-14)7(12-13)8(9,10)11/h5,14H,2-4H2,1H3
InChI Key:
PIZBBZLPNLGBIM-UHFFFAOYSA-N
SMILES:
OCCCc1cn(nc1C(F)(F)F)C
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.184g/mol
Monoisotopic Mass:
208.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties