200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 16255-14-4
16255-14-4 | Benzenemethanol, α-ethyl-4-nitro-, 1-nitrate
CAS No: 16255-14-4 Catalog No: AG001T91 MDL No:
Product Description
Catalog Number:
AG001T91
Chemical Name:
Benzenemethanol, α-ethyl-4-nitro-, 1-nitrate
CAS Number:
16255-14-4
Molecular Formula:
C9H10N2O5
Molecular Weight:
226.1861
IUPAC Name:
1-(4-nitrophenyl)propyl nitrate
InChI:
InChI=1S/C9H10N2O5/c1-2-9(16-11(14)15)7-3-5-8(6-4-7)10(12)13/h3-6,9H,2H2,1H3
InChI Key:
FGVIZJUFMNFQBO-UHFFFAOYSA-N
SMILES:
CCC(c1ccc(cc1)[N+](=O)[O-])O[N+](=O)[O-]
NSC Number:
33073
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.059g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.188g/mol
Monoisotopic Mass:
226.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.