Name: Name:3H-Pyrazol-3-one,1,2-dihydro-1,5-dimethyl-4-nitroso-2-phenyl-
Brand: Angene
SKU: AG008A80
Rating: 90 (10 reviews)

3H-Pyrazol-3-one,1,2-dihydro-1,5-dimethyl-4-nitroso-2-phenyl-

CAS No.:

885-11-0

Catalog Number:

AG008A80

Molecular Formula:

C11H11N3O2

Molecular Weight:

217.2239

Catalog Number:

AG008A80

Chemical Name:

3H-Pyrazol-3-one,1,2-dihydro-1,5-dimethyl-4-nitroso-2-phenyl-

CAS Number:

885-11-0

Molecular Formula:

C11H11N3O2

Molecular Weight:

217.2239

MDL Number:

MFCD00085574

IUPAC Name:

1,5-dimethyl-4-nitroso-2-phenylpyrazol-3-one

InChI:

InChI=1S/C11H11N3O2/c1-8-10(12-16)11(15)14(13(8)2)9-6-4-3-5-7-9/h3-7H,1-2H3

InChI Key:

IEODZSWSXNQPQL-UHFFFAOYSA-N

SMILES:

O=Nc1c(C)n(n(c1=O)c1ccccc1)C

EC Number:

212-941-6

UNII:

6E87K64L4I

Complexity:

345

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

217.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

217.228g/mol

Monoisotopic Mass:

217.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2