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1649978-70-0 | 6,7,8-trihydroxy-3,4-dihydroisoquinoline-3-carboxylicacid
CAS No: 1649978-70-0 Catalog No: AG01FM49 MDL No:
Product Description
Catalog Number:
AG01FM49
Chemical Name:
6,7,8-trihydroxy-3,4-dihydroisoquinoline-3-carboxylicacid
CAS Number:
1649978-70-0
IUPAC Name:
6,7,8-trihydroxy-3,4-dihydroisoquinoline-3-carboxylic acid
InChI:
InChI=1S/C10H9NO5/c12-7-2-4-1-6(10(15)16)11-3-5(4)8(13)9(7)14/h2-3,6,12-14H,1H2,(H,15,16)
InChI Key:
SOLHVMMAXFEAKH-UHFFFAOYSA-N
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.048g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
223.184g/mol
Monoisotopic Mass:
223.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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