200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 1270876-85-1
1270876-85-1 | 2-methyl-4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]benzaldehyde
CAS No: 1270876-85-1 Catalog No: AG01EMAX MDL No:MFCD17305416
Product Description
Catalog Number:
AG01EMAX
Chemical Name:
2-methyl-4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]benzaldehyde
CAS Number:
1270876-85-1
Molecular Formula:
C12H9F3N2O
Molecular Weight:
254.2079
MDL Number:
MFCD17305416
IUPAC Name:
2-methyl-4-[3-(trifluoromethyl)pyrazol-1-yl]benzaldehyde
InChI:
InChI=1S/C12H9F3N2O/c1-8-6-10(3-2-9(8)7-18)17-5-4-11(16-17)12(13,14)15/h2-7H,1H3
InChI Key:
UFGWSXJMTWOJAM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1C)n1ccc(n1)C(F)(F)F
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.067g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.212g/mol
Monoisotopic Mass:
254.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.