(1r,1's,4r,4'r)-4-(2,3-difluoro-4-methoxyphenyl)-4'-propyl-1,1'-bi(cyclohexane)

(1r,1's,4r,4'r)-4-(2,3-difluoro-4-methoxyphenyl)-4'-propyl-1,1'-bi(cyclohexane)

CAS: 431947-34-1

Formula: C22H32F2O

SMILES: CCC[C@H]1CC[C@@H](CC1)[C@H]1CC[C@@H](CC1)C1=CC=C(OC)C(F)=C1F

IUPAC: (1r,1's,4r,4'r)-4-(2,3-difluoro-4-methoxyphenyl)-4'-propyl-1,1'-bi(cyclohexane)

InChI: InChI=1/C22H32F2O/c1-3-4-15-5-7-16(8-6-15)17-9-11-18(12-10-17)19-13-14-20(25-2)22(24)21(19)23/h13-18H,3-12H2,1-2H3/t15-,16-,17-,18-

Composition: C (75.39%), H (9.20%), F (10.84%), O (4.56%)

Molar Mass: 350.494

Atom Count: 57

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	350.242121976
Formal Charge	0
FSP3	0.73
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	FRGPBGWMABUJNC-OPMHRUBENA-N
Lipinski's Rule of Five
Molar Refractivity	98.6
Topological Polar Surface Area	9.23
Polarizability	38.24
Ring Count	3
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	431947-34-1		$25.22-$262.29$25.22$87.01$262.29