Home Halogens 1-bromo-4-methyl-9H-thioxanthen-9-one

1-bromo-4-methyl-9H-thioxanthen-9-one

CAS No.:
1859087-87-8
Catalog Number:
AG01DJIZ
Molecular Formula:
C14H9BrOS
Molecular Weight:
305.1897
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Product Description
Catalog Number:
AG01DJIZ
Chemical Name:
1-bromo-4-methyl-9H-thioxanthen-9-one
CAS Number:
1859087-87-8
Molecular Formula:
C14H9BrOS
Molecular Weight:
305.1897
MDL Number:
MFCD31652595
IUPAC Name:
1-bromo-4-methylthioxanthen-9-one
InChI:
InChI=1S/C14H9BrOS/c1-8-6-7-10(15)12-13(16)9-4-2-3-5-11(9)17-14(8)12/h2-7H,1H3
InChI Key:
QFUJJBSGLCDRNY-UHFFFAOYSA-N
SMILES:
Cc1ccc(c2c1sc1ccccc1c2=O)Br
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.956g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.189g/mol
Monoisotopic Mass:
303.956g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties