Name: Name:1-(1-tert-butyl-4-hydroxy-1H-pyrazol-3-yl)ethan-1-one
Brand: Angene
SKU: AG01ACZE
Rating: 90 (10 reviews)

1-(1-tert-butyl-4-hydroxy-1H-pyrazol-3-yl)ethan-1-one

CAS No.:

1197815-66-9

Catalog Number:

AG01ACZE

Molecular Formula:

C9H14N2O2

Molecular Weight:

182.2197

Catalog Number:

AG01ACZE

Chemical Name:

1-(1-tert-butyl-4-hydroxy-1H-pyrazol-3-yl)ethan-1-one

CAS Number:

1197815-66-9

Molecular Formula:

C9H14N2O2

Molecular Weight:

182.2197

MDL Number:

MFCD17926206

IUPAC Name:

1-(1-tert-butyl-4-hydroxypyrazol-3-yl)ethanone

InChI:

InChI=1S/C9H14N2O2/c1-6(12)8-7(13)5-11(10-8)9(2,3)4/h5,13H,1-4H3

InChI Key:

PRYVLCUXMUSTBM-UHFFFAOYSA-N

SMILES:

CC(=O)c1nn(cc1O)C(C)(C)C

Complexity:

210

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

182.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

182.223g/mol

Monoisotopic Mass:

182.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3