5H-1-Benzazepin-5-one, 1,2,3,4-tetrahydro-1-[(4-methylphenyl)sulfonyl]-


Chemical Name: 5H-1-Benzazepin-5-one, 1,2,3,4-tetrahydro-1-[(4-methylphenyl)sulfonyl]-
CAS Number: 24310-36-9
Product Number: AG006WKF(AGN-PC-0JO055)
Synonyms:
MDL No: MFCD00795994
Molecular Formula: C17H17NO3S
Molecular Weight: 315.3868

Identification/Properties


Properties
MP:
126℃(Solv: methanol (67-56-1))
BP:
489.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
315.387g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
315.093g/mol
Monoisotopic Mass:
315.093g/mol
Topological Polar Surface Area:
62.8A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
503
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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