200,000+ products from a single source!
sales@angenechem.com
1645-96-1 | 1,3-Benzodioxole, 2,2-difluoro-5-nitro-
CAS No: 1645-96-1 Catalog No: AG001UX4 MDL No:MFCD02250294
Product Description
Catalog Number:
AG001UX4
Chemical Name:
1,3-Benzodioxole, 2,2-difluoro-5-nitro-
CAS Number:
1645-96-1
Molecular Formula:
C7H3F2NO4
Molecular Weight:
203.0998
MDL Number:
MFCD02250294
IUPAC Name:
2,2-difluoro-5-nitro-1,3-benzodioxole
InChI:
InChI=1S/C7H3F2NO4/c8-7(9)13-5-2-1-4(10(11)12)3-6(5)14-7/h1-3H
InChI Key:
YCLXTFDBDIYVPZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)OC(O2)(F)F
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.003g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.101g/mol
Monoisotopic Mass:
203.003g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.