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1391052-14-4

1391052-14-4 | 10H-Phenothiazine-10-propyl 10-Methanethiosulfonate

CAS No: 1391052-14-4 Catalog No: AG009ETI MDL No:

Product Description

Catalog Number:
AG009ETI
Chemical Name:
10H-Phenothiazine-10-propyl 10-Methanethiosulfonate
CAS Number:
1391052-14-4
IUPAC Name:
10-(3-methylsulfanylsulfonylpropyl)phenothiazine
InChI:
InChI=1S/C16H17NO2S3/c1-20-22(18,19)12-6-11-17-13-7-2-4-9-15(13)21-16-10-5-3-8-14(16)17/h2-5,7-10H,6,11-12H2,1H3
InChI Key:
IXGFKUYZOBPXIG-UHFFFAOYSA-N

Properties

Complexity:
441  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.042g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.497g/mol
Monoisotopic Mass:
351.042g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
96.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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