Name: Name:4-methyl-2-{[1-(propan-2-yl)-1H-pyrazol-3-yl]methyl}pentanoic acid hydrochloride
Brand: Angene
SKU: AG01C15Q
Rating: 90 (10 reviews)

4-methyl-2-{[1-(propan-2-yl)-1H-pyrazol-3-yl]methyl}pentanoic acid hydrochloride

CAS No.:

1864062-03-2

Catalog Number:

AG01C15Q

Molecular Formula:

C13H23ClN2O2

Molecular Weight:

274.7869

Catalog Number:

AG01C15Q

Chemical Name:

4-methyl-2-{[1-(propan-2-yl)-1H-pyrazol-3-yl]methyl}pentanoic acid hydrochloride

CAS Number:

1864062-03-2

Molecular Formula:

C13H23ClN2O2

Molecular Weight:

274.7869

MDL Number:

MFCD29041292

IUPAC Name:

4-methyl-2-[(1-propan-2-ylpyrazol-3-yl)methyl]pentanoic acid;hydrochloride

InChI:

InChI=1S/C13H22N2O2.ClH/c1-9(2)7-11(13(16)17)8-12-5-6-15(14-12)10(3)4;/h5-6,9-11H,7-8H2,1-4H3,(H,16,17);1H

InChI Key:

OVFFVXSEFWSKSF-UHFFFAOYSA-N

SMILES:

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

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

274.145g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

274.789g/mol

Monoisotopic Mass:

274.145g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: