Home Halogens 9H-Thioxanthen-9-one,1-chloro-4-propoxy-

9H-Thioxanthen-9-one,1-chloro-4-propoxy-

CAS No.:
142770-42-1
Catalog Number:
AG006XIN
Molecular Formula:
C16H13ClO2S
Molecular Weight:
304.7912
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Product Description
Catalog Number:
AG006XIN
Chemical Name:
9H-Thioxanthen-9-one,1-chloro-4-propoxy-
CAS Number:
142770-42-1
Molecular Formula:
C16H13ClO2S
Molecular Weight:
304.7912
MDL Number:
MFCD00191928
IUPAC Name:
1-chloro-4-propoxythioxanthen-9-one
InChI:
InChI=1S/C16H13ClO2S/c1-2-9-19-12-8-7-11(17)14-15(18)10-5-3-4-6-13(10)20-16(12)14/h3-8H,2,9H2,1H3
InChI Key:
VKQJCUYEEABXNK-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(c2c1sc1ccccc1c2=O)Cl
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.032g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.788g/mol
Monoisotopic Mass:
304.032g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties