Name: Name:1-(1-tert-butyl-3-methyl-1H-pyrazol-4-yl)ethan-1-one
Brand: Angene
SKU: AG019X0T
Rating: 90 (10 reviews)

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

CAS No.:

1197859-35-0

Catalog Number:

AG019X0T

Molecular Formula:

C10H16N2O

Molecular Weight:

180.2468

Catalog Number:

AG019X0T

Chemical Name:

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

CAS Number:

1197859-35-0

Molecular Formula:

C10H16N2O

Molecular Weight:

180.2468

MDL Number:

MFCD13195931

IUPAC Name:

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

InChI:

InChI=1S/C10H16N2O/c1-7-9(8(2)13)6-12(11-7)10(3,4)5/h6H,1-5H3

InChI Key:

UKBSYRPUXFBPFQ-UHFFFAOYSA-N

SMILES:

CC(=O)c1cn(nc1C)C(C)(C)C

Complexity:

208

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.126g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.251g/mol

Monoisotopic Mass:

180.126g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2