Name: Name:3-(chloromethyl)-1-phenyl-1H,4H,5H,6H-cyclopenta[c]pyrazole
Brand: Angene
SKU: AG019XRV
Rating: 90 (10 reviews)

3-(chloromethyl)-1-phenyl-1H,4H,5H,6H-cyclopenta[c]pyrazole

CAS No.:

123345-76-6

Catalog Number:

AG019XRV

Molecular Formula:

C13H13ClN2

Molecular Weight:

232.7087

Catalog Number:

AG019XRV

Chemical Name:

3-(chloromethyl)-1-phenyl-1H,4H,5H,6H-cyclopenta[c]pyrazole

CAS Number:

123345-76-6

Molecular Formula:

C13H13ClN2

Molecular Weight:

232.7087

MDL Number:

MFCD14705595

IUPAC Name:

3-(chloromethyl)-1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole

InChI:

InChI=1S/C13H13ClN2/c14-9-12-11-7-4-8-13(11)16(15-12)10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2

InChI Key:

JZQCNZOQBXKTDJ-UHFFFAOYSA-N

SMILES:

ClCc1nn(c2c1CCC2)c1ccccc1

Complexity:

240

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

232.077g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

232.711g/mol

Monoisotopic Mass:

232.077g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: