Home Nitros 1-(3-Methylbutyl)-4-nitro-1h-pyrazole

1-(3-Methylbutyl)-4-nitro-1h-pyrazole

CAS No.:
1240573-73-2
Catalog Number:
AG000LGG
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$307
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Product Description
Catalog Number:
AG000LGG
Chemical Name:
1-(3-Methylbutyl)-4-nitro-1h-pyrazole
CAS Number:
1240573-73-2
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
MDL Number:
MFCD16810719
IUPAC Name:
1-(3-methylbutyl)-4-nitropyrazole
InChI:
InChI=1S/C8H13N3O2/c1-7(2)3-4-10-6-8(5-9-10)11(12)13/h5-7H,3-4H2,1-2H3
InChI Key:
YVXROGVHFOYTNG-UHFFFAOYSA-N
SMILES:
CC(CCn1ncc(c1)[N+](=O)[O-])C
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.101g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.211g/mol
Monoisotopic Mass:
183.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties