200,000+ products from a single source!
sales@angenechem.com
88032-02-4 | 2-Butene-1,1,4-triol, 2-methyl-, triacetate
CAS No: 88032-02-4 Catalog No: AG004GGD MDL No:
Product Description
Catalog Number:
AG004GGD
Chemical Name:
2-Butene-1,1,4-triol, 2-methyl-, triacetate
CAS Number:
88032-02-4
Molecular Formula:
C11H22O9
Molecular Weight:
298.2870
IUPAC Name:
acetic acid;2-methylbut-2-ene-1,1,4-triol
InChI:
InChI=1S/C5H10O3.3C2H4O2/c1-4(2-3-6)5(7)8;3*1-2(3)4/h2,5-8H,3H2,1H3;3*1H3,(H,3,4)
InChI Key:
PPBYUQYCWVDXOV-UHFFFAOYSA-N
SMILES:
CC(=O)O.CC(=O)O.CC(=O)O.OCC=C(C(O)O)C
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.126g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
298.288g/mol
Monoisotopic Mass:
298.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
173A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.