200,000+ products from a single source!
sales@angenechem.com
1349718-84-8 | 4-Bromo-5-isobutyl-2-phenyl-2H-pyrazol-3-ylamine
CAS No: 1349718-84-8 Catalog No: AG01F9I8 MDL No:MFCD20233402
Product Description
Catalog Number:
AG01F9I8
Chemical Name:
4-Bromo-5-isobutyl-2-phenyl-2H-pyrazol-3-ylamine
CAS Number:
1349718-84-8
Molecular Formula:
C13H16BrN3
Molecular Weight:
294.1902
MDL Number:
MFCD20233402
IUPAC Name:
4-bromo-5-(2-methylpropyl)-2-phenylpyrazol-3-amine
InChI:
InChI=1S/C13H16BrN3/c1-9(2)8-11-12(14)13(15)17(16-11)10-6-4-3-5-7-10/h3-7,9H,8,15H2,1-2H3
InChI Key:
PBTXYRKCDOMIMF-UHFFFAOYSA-N
SMILES:
CC(Cc1nn(c(c1Br)N)c1ccccc1)C
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.053g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.196g/mol
Monoisotopic Mass:
293.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.