200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 131394-19-9
131394-19-9 | 2-Propanone, 1-(5-nitro-2H-tetrazol-2-yl)-
CAS No: 131394-19-9 Catalog No: AG000W2Z MDL No:MFCD00507832
Product Description
Catalog Number:
AG000W2Z
Chemical Name:
2-Propanone, 1-(5-nitro-2H-tetrazol-2-yl)-
CAS Number:
131394-19-9
Molecular Formula:
C4H5N5O3
Molecular Weight:
171.1142
MDL Number:
MFCD00507832
IUPAC Name:
1-(5-nitrotetrazol-2-yl)propan-2-one
InChI:
InChI=1S/C4H5N5O3/c1-3(10)2-8-6-4(5-7-8)9(11)12/h2H2,1H3
InChI Key:
RNOFFEQSFLGZHK-UHFFFAOYSA-N
SMILES:
CC(=O)Cn1nnc(n1)[N+](=O)[O-]
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.039g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.116g/mol
Monoisotopic Mass:
171.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.