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6044-61-7 | 3,7-dioctyl-10H-phenothiazine
CAS No: 6044-61-7 Catalog No: AG00EV6R MDL No:
Product Description
Catalog Number:
AG00EV6R
Chemical Name:
3,7-dioctyl-10H-phenothiazine
CAS Number:
6044-61-7
IUPAC Name:
3,7-dioctyl-10H-phenothiazine
InChI:
InChI=1S/C28H41NS/c1-3-5-7-9-11-13-15-23-17-19-25-27(21-23)30-28-22-24(18-20-26(28)29-25)16-14-12-10-8-6-4-2/h17-22,29H,3-16H2,1-2H3
InChI Key:
STGFANHLXUILNY-UHFFFAOYSA-N
EC Number:
227-935-9
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
423.296g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
423.703g/mol
Monoisotopic Mass:
423.296g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
11.7
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