Perfluorotetradecanoic Acid

CAT: 1596-AR-P30945-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-P30945-02Size:25 Units

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CAS Number

376-06-7

Molecular Formula

C14HF27O2

Molecular Weight

714.12

API Name

Perfluorotetradecanoic acid

Chemical Information

Perfluorotetradecanoic acid

CAS Number	376-06-7
PubChem CID	67822
IUPAC Name	2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-heptacosafluorotetradecanoic acid
Molecular Formula	C14HF27O2
Molecular Weight	714.11
XLogP	9
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	29
Rotatable Bond Count	12
Heavy Atom Count	43
Formal Charge	0
Complexity	1060

SMILES

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

InChI

InChI=1S/C14HF27O2/c15-2(16,1(42)43)3(17,18)4(19,20)5(21,22)6(23,24)7(25,26)8(27,28)9(29,30)10(31,32)11(33,34)12(35,36)13(37,38)14(39,40)41/h(H,42,43)

InChIKey

RUDINRUXCKIXAJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 376-06-7

CID: 67822

Formula: C14HF27O2

MW: 714.11

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	714.11
XLogP3	9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	29
Rotatable Bond Count	12
Exact Mass	713.9545396
Monoisotopic Mass	713.9545396
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	43
Formal Charge	0
Complexity	1060
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

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Perfluorotetradecanoic Acid

Chemical Information

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