Home Other Building Blocks {1-phenyl-1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}methanamine hydrochloride

{1-phenyl-1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}methanamine hydrochloride

CAS No.:
1193389-93-3
Catalog Number:
AG019VUX
Molecular Formula:
C13H16ClN3
Molecular Weight:
249.7392
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Product Description
Catalog Number:
AG019VUX
Chemical Name:
{1-phenyl-1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}methanamine hydrochloride
CAS Number:
1193389-93-3
Molecular Formula:
C13H16ClN3
Molecular Weight:
249.7392
MDL Number:
MFCD12197253
IUPAC Name:
(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methanamine;hydrochloride
InChI:
InChI=1S/C13H15N3.ClH/c14-9-12-11-7-4-8-13(11)16(15-12)10-5-2-1-3-6-10;/h1-3,5-6H,4,7-9,14H2;1H
InChI Key:
VJFHTPZYVRHBJA-UHFFFAOYSA-N
SMILES:
NCc1nn(c2c1CCC2)c1ccccc1.Cl
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.103g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.742g/mol
Monoisotopic Mass:
249.103g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties