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141975-72-6 | Benzenesulfenamide, 2-nitro-N-(2,2,2-trichloro-1-hydroxyethyl)-
CAS No: 141975-72-6 Catalog No: AG001HGZ MDL No:
Product Description
Catalog Number:
AG001HGZ
Chemical Name:
Benzenesulfenamide, 2-nitro-N-(2,2,2-trichloro-1-hydroxyethyl)-
CAS Number:
141975-72-6
Molecular Formula:
C8H7Cl3N2O3S
Molecular Weight:
317.5768
IUPAC Name:
2,2,2-trichloro-1-[(2-nitrophenyl)sulfanylamino]ethanol
InChI:
InChI=1S/C8H7Cl3N2O3S/c9-8(10,11)7(14)12-17-6-4-2-1-3-5(6)13(15)16/h1-4,7,12,14H
InChI Key:
RXUSUGPQGCDLCA-UHFFFAOYSA-N
SMILES:
OC(C(Cl)(Cl)Cl)NSc1ccccc1[N+](=O)[O-]
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.924g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
317.565g/mol
Monoisotopic Mass:
315.924g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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