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83538-81-2 | 3,4,5,6-tetrahydrobenzo[c]acridine-3,4,5,6-tetrol
CAS No: 83538-81-2 Catalog No: AG004V1Z MDL No:
Product Description
Catalog Number:
AG004V1Z
Chemical Name:
3,4,5,6-tetrahydrobenzo[c]acridine-3,4,5,6-tetrol
CAS Number:
83538-81-2
Molecular Formula:
C17H15NO4
Molecular Weight:
297.3053
IUPAC Name:
3,4,5,6-tetrahydrobenzo[c]acridine-3,4,5,6-tetrol
InChI:
InChI=1S/C17H15NO4/c19-12-6-5-9-13(16(12)21)17(22)15(20)10-7-8-3-1-2-4-11(8)18-14(9)10/h1-7,12,15-17,19-22H
InChI Key:
GCXYIZOJYVDZQP-UHFFFAOYSA-N
SMILES:
OC1C=CC2=C(C1O)C(O)C(c1c2nc2ccccc2c1)O
Properties
Complexity:
517
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.1g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
297.31g/mol
Monoisotopic Mass:
297.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
93.8A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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