200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 88226-59-9
88226-59-9 | Pentanoic acid, 2-[(acetyloxy)methyl]-2-nitro-, ethyl ester
CAS No: 88226-59-9 Catalog No: AG004B7T MDL No:
Product Description
Catalog Number:
AG004B7T
Chemical Name:
Pentanoic acid, 2-[(acetyloxy)methyl]-2-nitro-, ethyl ester
CAS Number:
88226-59-9
Molecular Formula:
C10H17NO6
Molecular Weight:
247.2451
IUPAC Name:
ethyl 2-(acetyloxymethyl)-2-nitropentanoate
InChI:
InChI=1S/C10H17NO6/c1-4-6-10(11(14)15,7-17-8(3)12)9(13)16-5-2/h4-7H2,1-3H3
InChI Key:
MLEJMNJVBLUIJZ-UHFFFAOYSA-N
SMILES:
CCCC(C(=O)OCC)([N+](=O)[O-])COC(=O)C
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.106g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.247g/mol
Monoisotopic Mass:
247.106g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.