200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 158822-44-7
158822-44-7 | 1,3-Benzodioxole, 5-fluoro-2,2-dimethyl-
CAS No: 158822-44-7 Catalog No: AG001QW4 MDL No:
Product Description
Catalog Number:
AG001QW4
Chemical Name:
1,3-Benzodioxole, 5-fluoro-2,2-dimethyl-
CAS Number:
158822-44-7
Molecular Formula:
C9H9FO2
Molecular Weight:
168.1650
IUPAC Name:
5-fluoro-2,2-dimethyl-1,3-benzodioxole
InChI:
InChI=1S/C9H9FO2/c1-9(2)11-7-4-3-6(10)5-8(7)12-9/h3-5H,1-2H3
InChI Key:
YRBMKKTXTVYSAW-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)OC(O2)(C)C
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.167g/mol
Monoisotopic Mass:
168.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.