Home Other Building Blocks (3-CHLOROSTYRYL)-1H-PYRAZOLE

(3-CHLOROSTYRYL)-1H-PYRAZOLE

CAS No.:
852691-01-1
Catalog Number:
AG008FPD
Molecular Formula:
C11H9ClN2
Molecular Weight:
204.6556
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Product Description
Catalog Number:
AG008FPD
Chemical Name:
(3-CHLOROSTYRYL)-1H-PYRAZOLE
CAS Number:
852691-01-1
Molecular Formula:
C11H9ClN2
Molecular Weight:
204.6556
MDL Number:
MFCD00120939
IUPAC Name:
5-[(E)-2-(4-chlorophenyl)ethenyl]-1H-pyrazole
InChI:
InChI=1S/C11H9ClN2/c12-10-4-1-9(2-5-10)3-6-11-7-8-13-14-11/h1-8H,(H,13,14)/b6-3+
InChI Key:
SHJXJPOMWYIJSA-ZZXKWVIFSA-N
SMILES:
Clc1cccc(c1)C=Cn1cccn1
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
204.045g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.657g/mol
Monoisotopic Mass:
204.045g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties