Name: Name:1-[1-(propan-2-yl)-1H-pyrazol-3-yl]propan-2-one
Brand: Angene
SKU: AG01A699
Rating: 90 (10 reviews)

1-[1-(propan-2-yl)-1H-pyrazol-3-yl]propan-2-one

CAS No.:

1342027-45-5

Catalog Number:

AG01A699

Molecular Formula:

C9H14N2O

Molecular Weight:

166.2203

Catalog Number:

AG01A699

Chemical Name:

1-[1-(propan-2-yl)-1H-pyrazol-3-yl]propan-2-one

CAS Number:

1342027-45-5

Molecular Formula:

C9H14N2O

Molecular Weight:

166.2203

MDL Number:

MFCD20412710

IUPAC Name:

1-(1-propan-2-ylpyrazol-3-yl)propan-2-one

InChI:

InChI=1S/C9H14N2O/c1-7(2)11-5-4-9(10-11)6-8(3)12/h4-5,7H,6H2,1-3H3

InChI Key:

PBCHIHKMHFDAMC-UHFFFAOYSA-N

SMILES:

CC(=O)Cc1ccn(n1)C(C)C

Complexity:

168

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

166.111g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

166.224g/mol

Monoisotopic Mass:

166.111g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6