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1723-70-2 | 8-Methoxyisoquinoline
CAS No: 1723-70-2 Catalog No: AG00AAZ3 MDL No:MFCD09258766
Product Description
Catalog Number:
AG00AAZ3
Chemical Name:
8-Methoxyisoquinoline
CAS Number:
1723-70-2
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD09258766
IUPAC Name:
8-methoxyisoquinoline
InChI:
InChI=1S/C10H9NO/c1-12-10-4-2-3-8-5-6-11-7-9(8)10/h2-7H,1H3
InChI Key:
HHZGHKIHHIKUHK-UHFFFAOYSA-N
SMILES:
COc1cccc2c1cncc2
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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