Name: Name:4-[4-(aminomethyl)-1-methyl-1H-pyrazol-3-yl]benzonitrile hydrochloride
Brand: Angene
SKU: AG01A5Z3
Rating: 90 (10 reviews)

4-[4-(aminomethyl)-1-methyl-1H-pyrazol-3-yl]benzonitrile hydrochloride

CAS No.:

1461707-38-9

Catalog Number:

AG01A5Z3

Molecular Formula:

C12H13ClN4

Molecular Weight:

248.7114

Catalog Number:

AG01A5Z3

Chemical Name:

4-[4-(aminomethyl)-1-methyl-1H-pyrazol-3-yl]benzonitrile hydrochloride

CAS Number:

1461707-38-9

Molecular Formula:

C12H13ClN4

Molecular Weight:

248.7114

MDL Number:

MFCD08445278

IUPAC Name:

4-[4-(aminomethyl)-1-methylpyrazol-3-yl]benzonitrile;hydrochloride

InChI:

InChI=1S/C12H12N4.ClH/c1-16-8-11(7-14)12(15-16)10-4-2-9(6-13)3-5-10;/h2-5,8H,7,14H2,1H3;1H

InChI Key:

JBOFLCMFMBAAOY-UHFFFAOYSA-N

SMILES:

NCc1cn(nc1c1ccc(cc1)C#N)C.Cl

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

248.083g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

248.714g/mol

Monoisotopic Mass:

248.083g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: