200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 832141-89-6
832141-89-6 | Benzaldehyde, 2-[3-(1,1-dimethylethyl)-5-methyl-1H-pyrazol-1-yl]-
CAS No: 832141-89-6 Catalog No: AG008IYA MDL No:
Product Description
Catalog Number:
AG008IYA
Chemical Name:
Benzaldehyde, 2-[3-(1,1-dimethylethyl)-5-methyl-1H-pyrazol-1-yl]-
CAS Number:
832141-89-6
Molecular Formula:
C15H18N2O
Molecular Weight:
242.3162
IUPAC Name:
2-(3-tert-butyl-5-methylpyrazol-1-yl)benzaldehyde
InChI:
InChI=1S/C15H18N2O/c1-11-9-14(15(2,3)4)16-17(11)13-8-6-5-7-12(13)10-18/h5-10H,1-4H3
InChI Key:
XYVVZXOVLQMFHV-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1n1nc(cc1C)C(C)(C)C
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.322g/mol
Monoisotopic Mass:
242.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.