200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 438031-81-3
438031-81-3 | 4-formyl-2-methoxyphenyl 2-methyl-5-nitrobenzene-1-sulfonate
CAS No: 438031-81-3 Catalog No: AG019GTW MDL No:MFCD03478380
Product Description
Catalog Number:
AG019GTW
Chemical Name:
4-formyl-2-methoxyphenyl 2-methyl-5-nitrobenzene-1-sulfonate
CAS Number:
438031-81-3
Molecular Formula:
C15H13NO7S
Molecular Weight:
351.3312
MDL Number:
MFCD03478380
IUPAC Name:
(4-formyl-2-methoxyphenyl) 2-methyl-5-nitrobenzenesulfonate
InChI:
InChI=1S/C15H13NO7S/c1-10-3-5-12(16(18)19)8-15(10)24(20,21)23-13-6-4-11(9-17)7-14(13)22-2/h3-9H,1-2H3
InChI Key:
FYMJPZKLZMQIDG-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)OC)OS(=O)(=O)c1cc(ccc1C)[N+](=O)[O-]
Properties
Complexity:
553
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.041g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.329g/mol
Monoisotopic Mass:
351.041g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.