Btffh

HCID 10935980CAS 164298-25-3

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Basic information

Standard SMILES: FC(N1CCCC1)=[N+]1CCCC1.F[P-](F)(F)(F)(F)F
InChIKey: MNJUGQKOHJQOCK-UHFFFAOYSA-N
Molecular formula: C9H16F7N2P
Average molar mass: 316.2 g/mol
Monoisotopic mass: 316.09393268

Overview

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Names & identifiers

Preferred name: Btffh
IUPAC: 1-[fluoro(pyrrolidin-1-ium-1-ylidene)methyl]pyrrolidine hexafluorophosphate
English name: Bis(tetramethylene)fluoroformamidinium hexafluorophosphate
Molecular formula: C9H16F7N2P
Molecular weight: 316.2

Names & synonyms

BTFFHDTXSID10448994RefChem:1080197DTXCID50399815164298-25-3Bis(tetramethylene)fluoroformamidinium hexafluorophosphateFluoro-N,N,N',N'-bis(tetramethylene)formamidinium hexafluorophosphate1-(Fluoro(pyrrolidin-1-yl)methylene)pyrrolidin-1-ium hexafluorophosphate(V)Fluoro-dipyrrolidinocarbenium hexafluorophosphate1-[fluoro(pyrrolidin-1-ium-1-ylidene)methyl]pyrrolidine;hexafluorophosphate1-(Fluoro(pyrrolidin-1-yl)methylene)pyrrolidin-1-iumhexafluorophosphate(V)MFCD02683430

Show more names

FLUORO-N,NBTFFH 98%FLUORO-N,N,N',N'-BIS(TETRAMETHYLENE)-Bis(tetraMethylene)fluoroforMaMidiniuMBTFFH, Fluoro-dipyrrolidinocarbenium hexafluorophosphatefluorobis(tetramethylene)formamidinium hexafluorophosphateBTFFH~Fluorobis(tetramethylene)formamidinium hexafluorophosphate

SCHEMBL19858657SCHEMBL30042960AKOS027327392CS-W009911FB15685AS-19126Fluoro-N,N,N inverted exclamation marka,N inverted exclamation marka-bis(tetramethylene)formamidinium hexafluorophosphateEN300-7402636

Database identifiers

CAS: 164298-25-3
PubChem CID: 10935980
DTXSID: DTXSID10448994

Properties

Computed structural properties

Topological polar surface area: 6.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 8
Rotatable bonds: 1
Heavy atoms: 19
Formal charge: 0
Complexity: 228

Physicochemical properties

Melting point: 154 · 154-160 °C
storage temp.: 2 · 2-8°C
form: Powder or Crystalline Powder
color: White to off-white
Sensitive: Moisture Sensitive
Major Application: peptide synthesis
InChI: InChI=1S/C9H16FN2.F6P/c10-9(11-5-1-2-6-11)12-7-3-4-8-12;1-7(2,3,4,5)6/h1-8H2;/q+1;-1
InChIKey: MNJUGQKOHJQOCK-UHFFFAOYSA-N
SMILES: N1(CCCC1)/C(/F)=[N+]1\CCCC\1.[P-](F)(F)(F)(F)(F)F
UNSPSC Code: 12352101 · 12352101
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
RIDADR: 3261 · 3261
WGK Germany: 3 · 3
F: 3 · 3-10-21
HazardClass: 8 · 8
PackingGroup: III
HS Code: 29339900 · 29339900
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3