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1445322-57-5 | N-(4-ForMylphenyl)-N-MethanesulfonylMethanesulfonaMide
CAS No: 1445322-57-5 Catalog No: AG00AQID MDL No:MFCD25121761
Product Description
Catalog Number:
AG00AQID
Chemical Name:
N-(4-ForMylphenyl)-N-MethanesulfonylMethanesulfonaMide
CAS Number:
1445322-57-5
Molecular Formula:
C9H11NO5S2
Molecular Weight:
277.3173
MDL Number:
MFCD25121761
IUPAC Name:
N-(4-formylphenyl)-N-methylsulfonylmethanesulfonamide
InChI:
InChI=1S/C9H11NO5S2/c1-16(12,13)10(17(2,14)15)9-5-3-8(7-11)4-6-9/h3-7H,1-2H3
InChI Key:
BRCCIENXTHBMHV-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)N(S(=O)(=O)C)S(=O)(=O)C
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.008g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.309g/mol
Monoisotopic Mass:
277.008g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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