Methyl perfluoroundecanoate

CAT: 0024-sc-263708ASize: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-263708ASize:25 g

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CAS Number

203302-98-1

Chemical Information

Methyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecanoate

CAS Number	203302-98-1
PubChem CID	2775491
IUPAC Name	methyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecanoate
Molecular Formula	C12H3F21O2
Molecular Weight	578.12
XLogP	7.3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	23
Rotatable Bond Count	10
Heavy Atom Count	35
Formal Charge	0
Complexity	806

SMILES

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

InChI

InChI=1S/C12H3F21O2/c1-35-2(34)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)11(29,30)12(31,32)33/h1H3

InChIKey

CJFAZQXPXXDAQR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 203302-98-1

CID: 2775491

Formula: C12H3F21O2

MW: 578.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	578.12
XLogP3	7.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	23
Rotatable Bond Count	10
Exact Mass	577.9797707
Monoisotopic Mass	577.9797707
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	35
Formal Charge	0
Complexity	806
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-257438	Ethyl 11H-perfluoroundecanoate
sc-263705	Methyl perfluorododecanoate
sc-263705A	Methyl perfluorododecanoate
sc-230723	2,2,2-Trifluoroethyl 2H,2H,3H,3H-perfluoroundecanoate
sc-483471	Methyl Acrylamidoglycolate Methyl Ester
sc-484429	Methyl p-methyl-α-chlorophenylacetate
sc-358332	Methyl 4-[ (methylthio) methyl]benzoate
sc-346587	[ (3-bromophenyl) methyl] (methyl) amine
sc-218724	Methyl β-Neuraminic Acid, Methyl Ester
sc-353948A	Methyl 4-aminophenyl (methyl) carbamate

Catalog	Name
PC5142E	Methyl perfluoroundecanoate
PC3262-01	Ethyl 11H-perfluoroundecanoate
AR-L05996-01	Methyl ?-methyl-4-[ (2-oxocyclopentyl) methyl]benzeneacetate
TRC-M294845-2.5G	Methyl Decanoate(Methyl Caprate)
OR1092028	Methyl 4-methyl-α-oxobenzeneacetate
OR26323	Methyl (methylthio) methyl sulphone
CDA40203-01	Methyl acrylamidoglycolate methyl ester
1013001	METHYL TRIFLUOROMETHANESULFONATE (METHYL TRIFLATE )
050165-01	Chloro Methyl Methyl Ether
455891-01	Methyl Decanoate (Methyl Caprate)