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87657-24-7

87657-24-7 | Benzo[f]quinoline-7,9-diol, 1,2,3,4,4a,5,6,10b-octahydro-4-propyl-, cis-

CAS No: 87657-24-7 Catalog No: AG004O0R MDL No:

Product Description

Catalog Number:
AG004O0R
Chemical Name:
Benzo[f]quinoline-7,9-diol, 1,2,3,4,4a,5,6,10b-octahydro-4-propyl-, cis-
CAS Number:
87657-24-7
Molecular Formula:
C16H23NO2
Molecular Weight:
261.3593
IUPAC Name:
(4aS,10bR)-4-propyl-2,3,4a,5,6,10b-hexahydro-1H-benzo[f]quinoline-7,9-diol
InChI:
InChI=1S/C16H23NO2/c1-2-7-17-8-3-4-12-14-9-11(18)10-16(19)13(14)5-6-15(12)17/h9-10,12,15,18-19H,2-8H2,1H3/t12-,15+/m1/s1
InChI Key:
TYGSGNMVHWSEDM-DOMZBBRYSA-N
SMILES:
CCCN1CCC[C@H]2[C@@H]1CCc1c2cc(cc1O)O

Properties

Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
261.173g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
261.365g/mol
Monoisotopic Mass:
261.173g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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