Bis (Pentafluorophenyl) Carbonate

CAT: 1489-B1390-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:1489-B1390-01Size:1 g

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CAS Number

59483-84-0

Purity

0.98

Chemical Information

Dipentafluorophenylcarbonate

structure given in first source

CAS Number	59483-84-0
PubChem CID	2734833
IUPAC Name	bis(2,3,4,5,6-pentafluorophenyl) carbonate
Molecular Formula	C13F10O3
Molecular Weight	394.12
XLogP	4.6
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	4
Heavy Atom Count	26
Formal Charge	0
Complexity	439

SMILES

C1(=C(C(=C(C(=C1F)F)F)F)F)OC(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

InChI

InChI=1S/C13F10O3/c14-1-3(16)7(20)11(8(21)4(1)17)25-13(24)26-12-9(22)5(18)2(15)6(19)10(12)23

InChIKey

IOVVFSGCNWQFQT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 59483-84-0

CID: 2734833

Formula: C13F10O3

MW: 394.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	394.12
XLogP3	4.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	4
Exact Mass	393.96877548
Monoisotopic Mass	393.96877548
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	439
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
N2520-01	Bis (2,5-dioxopyrrolidin-1-yl) Carbonate
A3000-01	Ammonium Carbonate
L8921-01	Lithium Carbonate
P6911-01	Potassium Carbonate
L8920-01	Lithium carbonate
A7620-01	Ammonium Carbonate
C7430-01	Calcium Carbonate
S6360-01	Sodium carbonate-13C
S5240-01	Sodium Hydrogen Carbonate
S5184-01	Sodium Carbonate Anhydrous

Catalog	Name
FB38526-01	Bis (pentafluorophenyl) carbonate
sc-279429	Methyl pentafluorophenyl carbonate
241189	Pentafluorophenyl carbonate 98+%
abx183825-01	9-Fluorenylmethyl pentafluorophenyl carbonate
F01830-01	9-Fluorenylmethyl pentafluorophenyl carbonate 98%
PC5773-01	(Fluoren-9-yl) methyl pentafluorophenyl carbonate
PC1008588	Diphenyl[4- (phenylthio) phenyl]sulfonium Tetrakis (pentafluorophenyl) borate (ca. 40% in Propylene Carbonate)
XYA55360	Pentafluorophenyl ethanesulphonate
286563-01	Pentafluorophenyl Isocyanate
288446-01	Pentafluorophenyl Trifluoromethanesulfonate