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(1S,2R)-2-(trifluoromethyl)cyclohexan-1-ol

(1S,2R)-2-(trifluoromethyl)cyclohexan-1-ol

CAS: 91404-97-6

Formula: C7H11F3O

SMILES: O[C@H]1CCCC[C@H]1C(F)(F)F

IUPAC: (1S,2R)-2-(trifluoromethyl)cyclohexan-1-ol

InChI: InChI=1S/C7H11F3O/c8-7(9,10)5-3-1-2-4-6(5)11/h5-6,11H,1-4H2/t5-,6+/m1/s1

Composition: C (50.00%), H (6.59%), F (33.89%), O (9.51%)

Molar Mass: 168.159

Atom Count: 22

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 168.076199463
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey BGAGPUHWVOHHTP-RITPCOANSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.53
Topological Polar Surface Area 20.23
Polarizability 13
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 91404-97-6 $631.35-$4,597.70$631.35$1,147.70$4,597.70
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