Name: Name:3(5)-tert-Butyl-4-nitro-1H-pyrazole
Brand: Angene
SKU: AG00D3VN
Rating: 90 (10 reviews)

3(5)-tert-Butyl-4-nitro-1H-pyrazole

CAS No.:

38858-95-6

Catalog Number:

AG00D3VN

Molecular Formula:

C7H11N3O2

Molecular Weight:

169.1811

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

98%

In Stock USA

United States

$169

- +

95%

In Stock USA

United States

$535

- +

Product Description

Catalog Number:

AG00D3VN

Chemical Name:

3(5)-tert-Butyl-4-nitro-1H-pyrazole

CAS Number:

38858-95-6

Molecular Formula:

C7H11N3O2

Molecular Weight:

169.1811

MDL Number:

MFCD00127341

IUPAC Name:

5-tert-butyl-4-nitro-1H-pyrazole

InChI:

InChI=1S/C7H11N3O2/c1-7(2,3)6-5(10(11)12)4-8-9-6/h4H,1-3H3,(H,8,9)

InChI Key:

ZGZXLSKQZBZQOF-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1c[nH]nc1C(C)(C)C

Properties

Complexity:

182

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

169.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

169.184g/mol

Monoisotopic Mass:

169.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501