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53667-19-9 | 2-Benzyl-2,3-Dihydroisoquinolin-4(1H)-One
CAS No: 53667-19-9 Catalog No: AG00DIGJ MDL No:MFCD10000833
Product Description
Catalog Number:
AG00DIGJ
Chemical Name:
2-Benzyl-2,3-Dihydroisoquinolin-4(1H)-One
CAS Number:
53667-19-9
MDL Number:
MFCD10000833
IUPAC Name:
2-benzyl-1,3-dihydroisoquinolin-4-one
InChI:
InChI=1S/C16H15NO/c18-16-12-17(10-13-6-2-1-3-7-13)11-14-8-4-5-9-15(14)16/h1-9H,10-12H2
InChI Key:
XMROQWKQZGYVRT-UHFFFAOYSA-N
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.115g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.302g/mol
Monoisotopic Mass:
237.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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