Name: Name:Trans-4-(3,4,5-trifluorophenyl)-trans-4'-propylbicyclohexane
Brand: Angene
SKU: AG000ZRZ
Rating: 90 (10 reviews)

Trans-4-(3,4,5-trifluorophenyl)-trans-4'-propylbicyclohexane

CAS No.:

131819-23-3

Catalog Number:

AG000ZRZ

Molecular Formula:

C21H29F3

Molecular Weight:

338.4502

Pack Size

Purity

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Price(USD)

Quantity

95%

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United States

$138

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Catalog Number:

AG000ZRZ

Chemical Name:

Trans-4-(3,4,5-trifluorophenyl)-trans-4'-propylbicyclohexane

CAS Number:

131819-23-3

Molecular Formula:

C21H29F3

Molecular Weight:

338.4502

MDL Number:

MFCD09838998

IUPAC Name:

1,2,3-trifluoro-5-[4-(4-propylcyclohexyl)cyclohexyl]benzene

InChI:

InChI=1S/C21H29F3/c1-2-3-14-4-6-15(7-5-14)16-8-10-17(11-9-16)18-12-19(22)21(24)20(23)13-18/h12-17H,2-11H2,1H3

InChI Key:

FEWMLRARKGRCCE-UHFFFAOYSA-N

SMILES:

CCC[C@@H]1CC[C@H](CC1)[C@@H]1CC[C@H](CC1)c1cc(F)c(c(c1)F)F

EC Number:

603-522-2

Complexity:

357

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

338.222g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

338.458g/mol

Monoisotopic Mass:

338.222g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

8.5