200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 848178-51-8
848178-51-8 | 4-methanesulfonyl-2-nitro-1-(propan-2-yloxy)benzene
CAS No: 848178-51-8 Catalog No: AG019P4Q MDL No:MFCD07324848
Product Description
Catalog Number:
AG019P4Q
Chemical Name:
4-methanesulfonyl-2-nitro-1-(propan-2-yloxy)benzene
CAS Number:
848178-51-8
Molecular Formula:
C10H13NO5S
Molecular Weight:
259.2789
MDL Number:
MFCD07324848
IUPAC Name:
4-methylsulfonyl-2-nitro-1-propan-2-yloxybenzene
InChI:
InChI=1S/C10H13NO5S/c1-7(2)16-10-5-4-8(17(3,14)15)6-9(10)11(12)13/h4-7H,1-3H3
InChI Key:
CCEADYZDOBHDRL-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1[N+](=O)[O-])S(=O)(=O)C)C
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.051g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.276g/mol
Monoisotopic Mass:
259.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.