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Home > Nitro Compounds > 1803599-77-0
1803599-77-0 | 3-nitro-4-(2-oxo-1,3-oxazolidin-3-yl)benzene-1-sulfonyl chloride
CAS No: 1803599-77-0 Catalog No: AG01AFNK MDL No:MFCD27500935
Product Description
Catalog Number:
AG01AFNK
Chemical Name:
3-nitro-4-(2-oxo-1,3-oxazolidin-3-yl)benzene-1-sulfonyl chloride
CAS Number:
1803599-77-0
Molecular Formula:
C9H7ClN2O6S
Molecular Weight:
306.6797
MDL Number:
MFCD27500935
IUPAC Name:
3-nitro-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonyl chloride
InChI:
InChI=1S/C9H7ClN2O6S/c10-19(16,17)6-1-2-7(8(5-6)12(14)15)11-3-4-18-9(11)13/h1-2,5H,3-4H2
InChI Key:
OFCSSPXRRCHCKG-UHFFFAOYSA-N
SMILES:
O=C1OCCN1c1ccc(cc1[N+](=O)[O-])S(=O)(=O)Cl
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.971g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.673g/mol
Monoisotopic Mass:
305.971g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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