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4295-65-2 | 2-Chloro-9-(3-(dimethylamino)propyl)-thioxanthen-9-ol
CAS No: 4295-65-2 Catalog No: AG003H1A MDL No:
Product Description
Catalog Number:
AG003H1A
Chemical Name:
2-Chloro-9-(3-(dimethylamino)propyl)-thioxanthen-9-ol
CAS Number:
4295-65-2
IUPAC Name:
2-chloro-9-[3-(dimethylamino)propyl]thioxanthen-9-ol
InChI:
InChI=1S/C18H20ClNOS/c1-20(2)11-5-10-18(21)14-6-3-4-7-16(14)22-17-9-8-13(19)12-15(17)18/h3-4,6-9,12,21H,5,10-11H2,1-2H3
InChI Key:
YJINNJOMTOJZBH-UHFFFAOYSA-N
EC Number:
224-302-9
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.095g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
333.874g/mol
Monoisotopic Mass:
333.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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