200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1146629-83-5
1146629-83-5 | 1H-Pyrazole-1-propanenitrile, 4-bromo-β-cyclopentyl-, (βR)-
CAS No: 1146629-83-5 Catalog No: AG000EZ4 MDL No:MFCD16038969
Product Description
Catalog Number:
AG000EZ4
Chemical Name:
1H-Pyrazole-1-propanenitrile, 4-bromo-β-cyclopentyl-, (βR)-
CAS Number:
1146629-83-5
Molecular Formula:
C11H14BrN3
Molecular Weight:
268.1530
MDL Number:
MFCD16038969
IUPAC Name:
(3R)-3-(4-bromopyrazol-1-yl)-3-cyclopentylpropanenitrile
InChI:
InChI=1S/C11H14BrN3/c12-10-7-14-15(8-10)11(5-6-13)9-3-1-2-4-9/h7-9,11H,1-5H2/t11-/m1/s1
InChI Key:
XXUIJTAHLDUGJF-LLVKDONJSA-N
SMILES:
N#CC[C@@H](n1ncc(c1)Br)C1CCCC1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
267.037g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.158g/mol
Monoisotopic Mass:
267.037g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.