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69759-61-1

69759-61-1 | 2,7-Dichloro-alpha-[(dibutylamino);methyl]-9H-fluorene-4-methanol

CAS No: 69759-61-1 Catalog No: AG005I0W MDL No:MFCD12923306

Product Description

Catalog Number:
AG005I0W
Chemical Name:
2,7-Dichloro-alpha-[(dibutylamino);methyl]-9H-fluorene-4-methanol
CAS Number:
69759-61-1
Molecular Formula:
C23H29Cl2NO
Molecular Weight:
406.3885
MDL Number:
MFCD12923306
IUPAC Name:
2-(dibutylamino)-1-(2,7-dichloro-9H-fluoren-4-yl)ethanol
InChI:
InChI=1S/C23H29Cl2NO/c1-3-5-9-26(10-6-4-2)15-22(27)21-14-19(25)13-17-11-16-12-18(24)7-8-20(16)23(17)21/h7-8,12-14,22,27H,3-6,9-11,15H2,1-2H3
InChI Key:
DALUOHFKVYCDCW-UHFFFAOYSA-N
SMILES:
CCCCN(CC(c1cc(Cl)cc2c1c1ccc(cc1C2)Cl)O)CCCC
EC Number:
922-480-9

Properties

Complexity:
440  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
405.163g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
406.391g/mol
Monoisotopic Mass:
405.163g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5  

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