2- (2',4',6'-Trifluorophenoxy) propane

CAT: 0127-PC1022608-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-PC1022608-01Size:1 g

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CAS Number

1310416-65-9

MDL Number

MFCD19105349

Purity

97%

Smiles

C1 (c (cc (cc1F) F) F) OC (C) C

Chemical Information

2-(2',4',6'-Trifluorophenoxy)propane

CAS Number	1310416-65-9
PubChem CID	68165134
IUPAC Name	1,3,5-trifluoro-2-propan-2-yloxybenzene
Molecular Formula	C9H9F3O
Molecular Weight	190.16
XLogP	3
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	151

SMILES

CC(C)OC1=C(C=C(C=C1F)F)F

InChI

InChI=1S/C9H9F3O/c1-5(2)13-9-7(11)3-6(10)4-8(9)12/h3-5H,1-2H3

InChIKey

JINRVWMIXBBCLH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1310416-65-9

CID: 68165134

Formula: C9H9F3O

MW: 190.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	190.16
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	190.06054939
Monoisotopic Mass	190.06054939
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	151
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC3843-01	2- (2,3,6-Trifluorophenoxy) ethanol
PC110033	3-[4- (2,3,4-Trifluorophenoxy) phenyl]-1H-pyrazole
PC109502-01	3-Nitro-2- (3,4,5-trifluorophenoxy) pyridine
PC8188	2- (2,4-Difluorophenoxy) propane
PC7817P-01	2,4,6-Trifluorophenol
OR21754-01	4,4'- (Propane-2,2-diyl) dianiline
OR62060-01	4,4'-Propane-2,2-diylbis (2-aminophenol)
OR52373-01	2,2-Bis (4-cyanatophenyl) propane
PC7409-01	2- (4-Bromo-2-fluorophenoxy) propane
PC8218	2- (4'-Fluoro-2'-methoxyphenoxy) propane

Catalog	Name
WDC54912-01	4-Chloro-6- (propane-2-sulfonyl) quinoline
DQD62988-01	6- (Propane-2-sulfonyl) quinolin-4-ol
HY-W770283	4,4'- (Propane-2,2-diyl) bis (2,6-dichlorophenol) -d6
N211261	2-(4-Nitrophenyl-d4)propane
TRC-C994106-50MG	2-(4-Methylphenyl)propane-d14
FB33798-01	2,2-Bis (4-cyanatophenyl) propane
7418-16-8	2,2-BIS (4-OXOCYCLOHEXYL) PROPANE
ABA35576-01	4- (Propane-2-sulfonyl) aniline
419240-01	2,2-Bis (4-aminophenyl) propane
413314-01	2- (2'-Bromo-4'-fluorophenoxy) propane