200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 886493-36-3
886493-36-3 | 3-Chloro-5,6-dimethoxy-2-nitro-benzaldehyde
CAS No: 886493-36-3 Catalog No: AG01EY83 MDL No:
Product Description
Catalog Number:
AG01EY83
Chemical Name:
3-Chloro-5,6-dimethoxy-2-nitro-benzaldehyde
CAS Number:
886493-36-3
Molecular Formula:
C9H8ClNO5
Molecular Weight:
245.6165
IUPAC Name:
5-chloro-2,3-dimethoxy-6-nitrobenzaldehyde
InChI:
InChI=1S/C9H8ClNO5/c1-15-7-3-6(10)8(11(13)14)5(4-12)9(7)16-2/h3-4H,1-2H3
InChI Key:
ZQBRWPGRQHXROM-UHFFFAOYSA-N
SMILES:
COc1c(OC)cc(c(c1C=O)[N+](=O)[O-])Cl
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.009g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.615g/mol
Monoisotopic Mass:
245.009g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.