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244257-63-4 | 6-iodo-7-methoxyisoquinoline
CAS No: 244257-63-4 Catalog No: AG01DIWW MDL No:MFCD28661576
Product Description
Catalog Number:
AG01DIWW
Chemical Name:
6-iodo-7-methoxyisoquinoline
CAS Number:
244257-63-4
Molecular Formula:
C10H8INO
Molecular Weight:
285.0811
MDL Number:
MFCD28661576
IUPAC Name:
6-iodo-7-methoxyisoquinoline
InChI:
InChI=1S/C10H8INO/c1-13-10-5-8-6-12-3-2-7(8)4-9(10)11/h2-6H,1H3
InChI Key:
VWNBYMCAENDETE-UHFFFAOYSA-N
SMILES:
COc1cc2cnccc2cc1I
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.965g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.084g/mol
Monoisotopic Mass:
284.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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