4-Bromoperfluorodiphenyl ether

CAT: 0127-PC6629Size: 1 EachDry Ice: NoHazardous: No

1 / 1

CAT#:0127-PC6629Size:1 Each

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

14055-44-8

Synonyms

1-Bromo-4- (pentafluorophenoxy) -2,3,5,6-tetrafluorobenzene, 4-Bromo-2,2',3,3',4',5,5',6,6'-nonafluorodiphenyl ether

MDL Number

MFCD09763604

Purity

=95%

Smiles

Fc1c(F)c(F)c(Oc2c(F)c(F)c(Br)c(F)c2F)c(F)c1F

Chemical Information

1-(4-Bromo-2,3,5,6-tetrafluorophenoxy)-2,3,4,5,6-pentafluorobenzene

CAS Number	14055-44-8
PubChem CID	297558
IUPAC Name	1-bromo-2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentafluorophenoxy)benzene
Molecular Formula	C12BrF9O
Molecular Weight	411.02
XLogP	5
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	2
Heavy Atom Count	23
Formal Charge	0
Complexity	386

SMILES

C1(=C(C(=C(C(=C1F)F)F)F)F)OC2=C(C(=C(C(=C2F)F)Br)F)F

InChI

InChI=1S/C12BrF9O/c13-1-2(14)7(19)11(8(20)3(1)15)23-12-9(21)5(17)4(16)6(18)10(12)22

InChIKey

UHIGTBMVQHTRMG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 14055-44-8

CID: 297558

Formula: C12BrF9O

MW: 411.02

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	411.02
XLogP3	5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	2
Exact Mass	409.89888
Monoisotopic Mass	409.89888
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	386
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
OR4901-01	4,4'-Dinitrodiphenyl ether
BIPA119	4,4'-Diazidodiphenyl ether
PC1227J-01	4,4'-Difluorodiphenyl ether
OR3076	4,4'-Dibromodiphenyl ether
OR1021717	4-Iodophenyl ether
OR5646	4-Acetylphenyl ether
OR1030273-01	4-Tolyl Ether
PC3747E-01	4-Fluorodiphenyl ether
OR1021725	4-Isothiocyanatophenyl ether
OR1021692	4-Chlorophenyl ether

Catalog	Name
11015-22	4,4'-Diaminodiphenyl Ether
FD53938-01	4,4'-Diacetyldiphenyl ether
RG-A262404-01	4,4′-Dihydroxydibenzyl Ether
TRC-D493435-500MG	4,4'-Dihydroxydiphenyl Ether
TRC-D438540-1G	4,4'-Dichlorodiphenyl Ether
sc-226823	4,4'-Dinitrodiphenyl ether
JH160940	4-Tolyl ether
sc-284275A	4-Isothiocyanatophenyl ether
sc-232600	4-Chlorodiphenyl ether
abx184604	4-Bromophenyl ether