Name: Name:4-(5-imino-3,4-dimethyl-2,5-dihydro-1H-pyrazol-1-yl)benzonitrile
Brand: Angene
SKU: AG01AK73
Rating: 90 (10 reviews)

4-(5-imino-3,4-dimethyl-2,5-dihydro-1H-pyrazol-1-yl)benzonitrile

CAS No.:

1333648-15-9

Catalog Number:

AG01AK73

Molecular Formula:

C12H12N4

Molecular Weight:

212.2505

Catalog Number:

AG01AK73

Chemical Name:

4-(5-imino-3,4-dimethyl-2,5-dihydro-1H-pyrazol-1-yl)benzonitrile

CAS Number:

1333648-15-9

Molecular Formula:

C12H12N4

Molecular Weight:

212.2505

MDL Number:

MFCD26143888

IUPAC Name:

4-(5-amino-3,4-dimethylpyrazol-1-yl)benzonitrile

InChI:

InChI=1S/C12H12N4/c1-8-9(2)15-16(12(8)14)11-5-3-10(7-13)4-6-11/h3-6H,14H2,1-2H3

InChI Key:

IFUWXFUUTGOZIZ-UHFFFAOYSA-N

SMILES:

N#Cc1ccc(cc1)n1[nH]c(c(c1=N)C)C

Complexity:

287

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.256g/mol

Monoisotopic Mass:

212.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: