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680611-78-3

680611-78-3 | Phenol, 4-(1-cyclopentyl-7-fluoro-1H-indazol-3-yl)-

CAS No: 680611-78-3 Catalog No: AG006G3K MDL No:

Product Description

Catalog Number:
AG006G3K
Chemical Name:
Phenol, 4-(1-cyclopentyl-7-fluoro-1H-indazol-3-yl)-
CAS Number:
680611-78-3
Molecular Formula:
C18H17FN2O
Molecular Weight:
296.3388
IUPAC Name:
4-(1-cyclopentyl-7-fluoroindazol-3-yl)phenol
InChI:
InChI=1S/C18H17FN2O/c19-16-7-3-6-15-17(12-8-10-14(22)11-9-12)20-21(18(15)16)13-4-1-2-5-13/h3,6-11,13,22H,1-2,4-5H2
InChI Key:
IYPUUNMLLKLEOH-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1nn(c2c1cccc2F)C1CCCC1

Properties

Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.132g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.345g/mol
Monoisotopic Mass:
296.132g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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