Name: Name:2-{2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}aniline
Brand: Angene
SKU: AG019UIW
Rating: 90 (10 reviews)

2-{2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}aniline

CAS No.:

1181458-48-9

Catalog Number:

AG019UIW

Molecular Formula:

C12H13N3

Molecular Weight:

199.2517

Catalog Number:

AG019UIW

Chemical Name:

2-{2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}aniline

CAS Number:

1181458-48-9

Molecular Formula:

C12H13N3

Molecular Weight:

199.2517

MDL Number:

MFCD12197001

IUPAC Name:

2-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)aniline

InChI:

InChI=1S/C12H13N3/c13-10-6-2-1-4-8(10)12-9-5-3-7-11(9)14-15-12/h1-2,4,6H,3,5,7,13H2,(H,14,15)

InChI Key:

AXEHEHULZXWCAH-UHFFFAOYSA-N

SMILES:

Nc1ccccc1c1[nH]nc2c1CCC2

Complexity:

231

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

199.111g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

199.257g/mol

Monoisotopic Mass:

199.111g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9