200,000+ products from a single source!
sales@angenechem.com
88226-60-2 | Butanoic acid, 2-[(acetyloxy)methyl]-3-methyl-2-nitro-, ethyl ester
CAS No: 88226-60-2 Catalog No: AG004B4U MDL No:
Product Description
Catalog Number:
AG004B4U
Chemical Name:
Butanoic acid, 2-[(acetyloxy)methyl]-3-methyl-2-nitro-, ethyl ester
CAS Number:
88226-60-2
Molecular Formula:
C10H17NO6
Molecular Weight:
247.2451
IUPAC Name:
ethyl 2-(acetyloxymethyl)-3-methyl-2-nitrobutanoate
InChI:
InChI=1S/C10H17NO6/c1-5-16-9(13)10(7(2)3,11(14)15)6-17-8(4)12/h7H,5-6H2,1-4H3
InChI Key:
ULZHTTZMGLZVFY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C([N+](=O)[O-])(C(C)C)COC(=O)C
Properties
Complexity:
308
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:
7
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.