Home Other Building Blocks 6-phenyl-1lambda6,2-thiazinane-1,1-dione

6-phenyl-1lambda6,2-thiazinane-1,1-dione

CAS No.:
623581-89-5
Catalog Number:
AG01EINU
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
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Product Description
Catalog Number:
AG01EINU
Chemical Name:
6-phenyl-1lambda6,2-thiazinane-1,1-dione
CAS Number:
623581-89-5
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
MDL Number:
MFCD28158272
IUPAC Name:
6-phenylthiazinane 1,1-dioxide
InChI:
InChI=1S/C10H13NO2S/c12-14(13)10(7-4-8-11-14)9-5-2-1-3-6-9/h1-3,5-6,10-11H,4,7-8H2
InChI Key:
SHQXWTHWFCXYLR-UHFFFAOYSA-N
SMILES:
O=S1(=O)NCCCC1c1ccccc1
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties