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Home > Nitro Compounds > 98045-13-7
98045-13-7 | 2-Dibenzofuransulfonyl chloride, 7-nitro-
CAS No: 98045-13-7 Catalog No: AG00IK0U MDL No:MFCD12974712
Product Description
Catalog Number:
AG00IK0U
Chemical Name:
2-Dibenzofuransulfonyl chloride, 7-nitro-
CAS Number:
98045-13-7
Molecular Formula:
C12H6ClNO5S
Molecular Weight:
311.6977
MDL Number:
MFCD12974712
IUPAC Name:
7-nitrodibenzofuran-2-sulfonyl chloride
InChI:
InChI=1S/C12H6ClNO5S/c13-20(17,18)8-2-4-11-10(6-8)9-3-1-7(14(15)16)5-12(9)19-11/h1-6H
InChI Key:
VODKZJIRRUAGHK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)oc1c2cc(cc1)S(=O)(=O)Cl
Properties
Complexity:
499
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.966g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.692g/mol
Monoisotopic Mass:
310.966g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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