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769858-09-5

769858-09-5 |

CAS No: 769858-09-5 Catalog No: AG01FMWB MDL No:

Product Description

Catalog Number:
AG01FMWB
CAS Number:
769858-09-5
IUPAC Name:
2,3,4,5-tetrahydro-1λ6,4-benzothiazepine 1,1-dioxide
InChI:
InChI=1S/C9H11NO2S/c11-13(12)6-5-10-7-8-3-1-2-4-9(8)13/h1-4,10H,5-7H2
InChI Key:
UGWMPDCDNBCROY-UHFFFAOYSA-N

Properties

Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.252g/mol
Monoisotopic Mass:
197.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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