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378236-33-0 | 1(2H)-Isoquinolinone,3-ethyl-6-methoxy-(9CI)
CAS No: 378236-33-0 Catalog No: AG00CXIN MDL No:
Product Description
Catalog Number:
AG00CXIN
Chemical Name:
1(2H)-Isoquinolinone,3-ethyl-6-methoxy-(9CI)
CAS Number:
378236-33-0
IUPAC Name:
3-ethyl-6-methoxy-2H-isoquinolin-1-one
InChI:
InChI=1S/C12H13NO2/c1-3-9-6-8-7-10(15-2)4-5-11(8)12(14)13-9/h4-7H,3H2,1-2H3,(H,13,14)
InChI Key:
YFIKRHXPIRBCMY-UHFFFAOYSA-N
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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