Benzo(b)naphtho(1,2-d)thiophene :BCR-137R


Chemical Name: Benzo(b)naphtho(1,2-d)thiophene :BCR-137R
CAS Number: 205-43-6
Product Number: AG0029SE(AGN-PC-0WAJ1H)
Synonyms:
MDL No:
Molecular Formula: C16H10S
Molecular Weight: 234.3156

Identification/Properties


Computed Properties
Molecular Weight:
234.316g/mol
XLogP3:
5.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
234.05g/mol
Monoisotopic Mass:
234.05g/mol
Topological Polar Surface Area:
28.2A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
287
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:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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