Name: Name:5-amino-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde
Brand: Angene
SKU: AG01B9TT
Rating: 90 (10 reviews)

5-amino-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde

CAS No.:

52217-35-3

Catalog Number:

AG01B9TT

Molecular Formula:

C11H11N3O

Molecular Weight:

201.2245

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG01B9TT

Chemical Name:

5-amino-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde

CAS Number:

52217-35-3

Molecular Formula:

C11H11N3O

Molecular Weight:

201.2245

MDL Number:

MFCD00178662

IUPAC Name:

5-amino-3-methyl-1-phenylpyrazole-4-carbaldehyde

InChI:

InChI=1S/C11H11N3O/c1-8-10(7-15)11(12)14(13-8)9-5-3-2-4-6-9/h2-7H,12H2,1H3

InChI Key:

USUZLTADOLMXDK-UHFFFAOYSA-N

SMILES:

O=Cc1c(C)nn(c1N)c1ccccc1

Properties

Complexity:

228

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

201.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

201.229g/mol

Monoisotopic Mass:

201.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
5-Amino-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde hemihydrate: a polarized electronic structure within hydrogen-bonded sheets of R(10)(8)(34) rings.	Acta crystallographica. Section C, Crystal structure communications 20100101