200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 2090252-22-3
2090252-22-3 | 2-(2,2,2-trifluoroethyl)-2H,4H,5H,6H-cyclopenta[c]pyrazole-3-carbaldehyde
CAS No: 2090252-22-3 Catalog No: AG01BSNH MDL No:MFCD30727306
Product Description
Catalog Number:
AG01BSNH
Chemical Name:
2-(2,2,2-trifluoroethyl)-2H,4H,5H,6H-cyclopenta[c]pyrazole-3-carbaldehyde
CAS Number:
2090252-22-3
Molecular Formula:
C9H9F3N2O
Molecular Weight:
218.1758
MDL Number:
MFCD30727306
IUPAC Name:
2-(2,2,2-trifluoroethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbaldehyde
InChI:
InChI=1S/C9H9F3N2O/c10-9(11,12)5-14-8(4-15)6-2-1-3-7(6)13-14/h4H,1-3,5H2
InChI Key:
ICGORCFDGUKZHX-UHFFFAOYSA-N
SMILES:
O=Cc1n(nc2c1CCC2)CC(F)(F)F
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.179g/mol
Monoisotopic Mass:
218.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
© 2019 Angene International Limited. All rights Reserved.