Home Other Building Blocks 3'-(trifluoromethyl)-1',4',6',7'-tetrahydrospiro[1,3-dioxolane-2,5'-indazole]

3'-(trifluoromethyl)-1',4',6',7'-tetrahydrospiro[1,3-dioxolane-2,5'-indazole]

CAS No.:
1092459-45-4
Catalog Number:
AG01CA5B
Molecular Formula:
C10H11F3N2O2
Molecular Weight:
248.2017
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Product Description
Catalog Number:
AG01CA5B
Chemical Name:
3'-(trifluoromethyl)-1',4',6',7'-tetrahydrospiro[1,3-dioxolane-2,5'-indazole]
CAS Number:
1092459-45-4
Molecular Formula:
C10H11F3N2O2
Molecular Weight:
248.2017
MDL Number:
MFCD08447467
IUPAC Name:
3'-(trifluoromethyl)spiro[1,3-dioxolane-2,5'-1,4,6,7-tetrahydroindazole]
InChI:
InChI=1S/C10H11F3N2O2/c11-10(12,13)8-6-5-9(16-3-4-17-9)2-1-7(6)14-15-8/h1-5H2,(H,14,15)
InChI Key:
FVZMHORKMDVJBU-UHFFFAOYSA-N
SMILES:
FC(c1n[nH]c2c1CC1(OCCO1)CC2)(F)F
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.077g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.205g/mol
Monoisotopic Mass:
248.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties