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611187-05-4 | 2-(benzyloxy)isoquinoline-1,3(2H,4H)-dione
CAS No: 611187-05-4 Catalog No: AG00EOUZ MDL No:
Product Description
Catalog Number:
AG00EOUZ
Chemical Name:
2-(benzyloxy)isoquinoline-1,3(2H,4H)-dione
CAS Number:
611187-05-4
IUPAC Name:
2-phenylmethoxy-4H-isoquinoline-1,3-dione
InChI:
InChI=1S/C16H13NO3/c18-15-10-13-8-4-5-9-14(13)16(19)17(15)20-11-12-6-2-1-3-7-12/h1-9H,10-11H2
InChI Key:
LHIDMDRTGMUMAH-UHFFFAOYSA-N
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.284g/mol
Monoisotopic Mass:
267.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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