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264264-00-8 | 10H-Phenothiazine, 10-(2-ethylhexyl)-
CAS No: 264264-00-8 Catalog No: AG002T5Y MDL No:
Product Description
Catalog Number:
AG002T5Y
Chemical Name:
10H-Phenothiazine, 10-(2-ethylhexyl)-
CAS Number:
264264-00-8
Molecular Formula:
C20H25NS
Molecular Weight:
311.4842
IUPAC Name:
10-(2-ethylhexyl)phenothiazine
InChI:
InChI=1S/C20H25NS/c1-3-5-10-16(4-2)15-21-17-11-6-8-13-19(17)22-20-14-9-7-12-18(20)21/h6-9,11-14,16H,3-5,10,15H2,1-2H3
InChI Key:
HZZXPIXQXAODOT-UHFFFAOYSA-N
SMILES:
CCCCC(CN1c2ccccc2Sc2c1cccc2)CC
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.171g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.487g/mol
Monoisotopic Mass:
311.171g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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