200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 1240573-73-2
1240573-73-2 | 1H-Pyrazole, 1-(3-methylbutyl)-4-nitro-
CAS No: 1240573-73-2 Catalog No: AG000LGG MDL No:MFCD16810719
Product Description
Catalog Number:
AG000LGG
Chemical Name:
1H-Pyrazole, 1-(3-methylbutyl)-4-nitro-
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
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.