Name: Name:2-(4-phenyl-1H-pyrazol-1-yl)cyclobutane-1-carboxylic acid
Brand: Angene
SKU: AG01AUBI
Rating: 90 (10 reviews)

2-(4-phenyl-1H-pyrazol-1-yl)cyclobutane-1-carboxylic acid

CAS No.:

1509418-55-6

Catalog Number:

AG01AUBI

Molecular Formula:

C14H14N2O2

Molecular Weight:

242.2732

Catalog Number:

AG01AUBI

Chemical Name:

2-(4-phenyl-1H-pyrazol-1-yl)cyclobutane-1-carboxylic acid

CAS Number:

1509418-55-6

Molecular Formula:

C14H14N2O2

Molecular Weight:

242.2732

MDL Number:

MFCD23033403

IUPAC Name:

2-(4-phenylpyrazol-1-yl)cyclobutane-1-carboxylic acid

InChI:

InChI=1S/C14H14N2O2/c17-14(18)12-6-7-13(12)16-9-11(8-15-16)10-4-2-1-3-5-10/h1-5,8-9,12-13H,6-7H2,(H,17,18)

InChI Key:

SVRPQELBVVTWSW-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCC1n1ncc(c1)c1ccccc1

Complexity:

315

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.278g/mol

Monoisotopic Mass:

242.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8