200,000+ products from a single source!
sales@angenechem.com
129888-79-5 | 4H-1,3-Benzodioxin, 6-bromo-8-(chloromethyl)-
CAS No: 129888-79-5 Catalog No: AG000TRS MDL No:
Product Description
Catalog Number:
AG000TRS
Chemical Name:
4H-1,3-Benzodioxin, 6-bromo-8-(chloromethyl)-
CAS Number:
129888-79-5
Molecular Formula:
C9H8BrClO2
Molecular Weight:
263.5156
IUPAC Name:
6-bromo-8-(chloromethyl)-4H-1,3-benzodioxine
InChI:
InChI=1S/C9H8BrClO2/c10-8-1-6(3-11)9-7(2-8)4-12-5-13-9/h1-2H,3-5H2
InChI Key:
MJTVUEYQWXWQKF-UHFFFAOYSA-N
SMILES:
ClCc1cc(Br)cc2c1OCOC2
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.94g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.515g/mol
Monoisotopic Mass:
261.94g/mol
Rotatable Bond Count:
1
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.