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84712-97-0 | 2-[[[4-(PHENYLAZO)PHENYL]METHYL]SULFONYL]ETHANOL
CAS No: 84712-97-0 Catalog No: AG004PHR MDL No:
Product Description
Catalog Number:
AG004PHR
Chemical Name:
2-[[[4-(PHENYLAZO)PHENYL]METHYL]SULFONYL]ETHANOL
CAS Number:
84712-97-0
Molecular Formula:
C15H16N2O3S
Molecular Weight:
304.3641
IUPAC Name:
2-[(4-phenyldiazenylphenyl)methylsulfonyl]ethanol
InChI:
InChI=1S/C15H16N2O3S/c18-10-11-21(19,20)12-13-6-8-15(9-7-13)17-16-14-4-2-1-3-5-14/h1-9,18H,10-12H2
InChI Key:
SPHUPSSBTALAES-UHFFFAOYSA-N
SMILES:
OCCS(=O)(=O)Cc1ccc(cc1)N=Nc1ccccc1
EC Number:
283-788-0
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.088g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.364g/mol
Monoisotopic Mass:
304.088g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
87.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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