200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 26391-36-6
26391-36-6 | Butanal, 3-(acetyloxy)-
CAS No: 26391-36-6 Catalog No: AG002T0N MDL No:
Product Description
Catalog Number:
AG002T0N
Chemical Name:
Butanal, 3-(acetyloxy)-
CAS Number:
26391-36-6
Molecular Formula:
C6H10O3
Molecular Weight:
130.1418
IUPAC Name:
4-oxobutan-2-yl acetate
InChI:
InChI=1S/C6H10O3/c1-5(3-4-7)9-6(2)8/h4-5H,3H2,1-2H3
InChI Key:
PJUIOCJERYHCMA-UHFFFAOYSA-N
SMILES:
O=CCC(OC(=O)C)C
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.063g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.143g/mol
Monoisotopic Mass:
130.063g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.