Dimethyl perfluorosuberate

CAT: 0024-sc-268942Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-268942Size:5 g

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CAS Number

2062-20-6

Chemical Information

Dimethyl dodecafluorosuberate

CAS Number	2062-20-6
PubChem CID	2737122
IUPAC Name	dimethyl 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluorooctanedioate
Molecular Formula	C10H6F12O4
Molecular Weight	418.13
XLogP	4
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	9
Heavy Atom Count	26
Formal Charge	0
Complexity	520

SMILES

COC(=O)C(C(C(C(C(C(C(=O)OC)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C10H6F12O4/c1-25-3(23)5(11,12)7(15,16)9(19,20)10(21,22)8(17,18)6(13,14)4(24)26-2/h1-2H3

InChIKey

SLFDDMXEAUAENU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2062-20-6

CID: 2737122

Formula: C10H6F12O4

MW: 418.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	418.13
XLogP3	4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	9
Exact Mass	418.0074466
Monoisotopic Mass	418.0074466
Topological Polar Surface Area	52.6 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	520
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
sc-268930	Dimethyl 2,2-dimethyl-malonate
sc-474838	Dimethyl Tetradecanedioate
sc-263093	Dimethyl pyridineboronate
sc-285440A	Dimethyl tetradecafluoroazelate
sc-234737	Dimethyl glutaconate
sc-496643	Dimethyl Isopropylidenemalonate
sc-326855A	Dimethyl difluoromalonate
sc-285438A	Dimethyl hexadecafluorosebacate
sc-223945	Dimethyl acetylsuccinate
sc-486092	Dimethyl Methoxymalonate

Catalog	Name
PC3011	Dimethyl perfluorosuberate
GTR19203502-01	Chlorthal-dimethyl
GTR19201894	Dimethyl capramide
FD62526	Dimethyl Phthalate
FD40109-01	Dimethyl glutarate
FD34694-01	Dimethyl chlorothiophosphate
FD06000	Dimethyl epipodophyllotoxin
HDA49160	Dimethyl Cyclopentylmalonate
BAA73179-01	Dimethyl Dodecanedioate
FAA01830-01	Dimethyl Methoxymalonate