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20846-00-8 | Propane, 2-nitro-, ion(1-)
CAS No: 20846-00-8 Catalog No: AG002JQ4 MDL No:
Product Description
Catalog Number:
AG002JQ4
Chemical Name:
Propane, 2-nitro-, ion(1-)
CAS Number:
20846-00-8
IUPAC Name:
2-nitropropane
InChI:
InChI=1S/C3H6NO2/c1-3(2)4(5)6/h1-2H3/q-1
InChI Key:
MRHSGZMVLDOZCK-UHFFFAOYSA-N
Properties
Complexity:
54.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
88.04g/mol
Formal Charge:
-1
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
88.086g/mol
Monoisotopic Mass:
88.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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