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CAS No.:
1985607-83-7
Catalog Number:
AG01DYA2
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01DYA2
CAS Number:
1985607-83-7
MDL Number:
MFCD31693069
IUPAC Name:
7,8-difluoro-6,11-dihydrobenzo[c][1]benzothiepin-11-ol
InChI:
InChI=1S/C14H10F2OS/c15-11-6-5-8-10(13(11)16)7-18-12-4-2-1-3-9(12)14(8)17/h1-6,14,17H,7H2
InChI Key:
OBEXFUFBCNVOKB-UHFFFAOYSA-N
Properties
Complexity:
302  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.042g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
264.29g/mol
Monoisotopic Mass:
264.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties