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Bis(1-methylpropyl) phosphorofluoridate

HCID 102452
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Basic information

CAS
625-17-2
Standard SMILES
CCC(C)OP(=O)(F)OC(C)CC
InChIKey
JZZAQBZVRYPEAM-UHFFFAOYSA-N
Molecular formula
C8H18FO3P
Average molar mass
212.2 g/mol
Monoisotopic mass
212.09775959

Names & identifiers

Preferred name
Bis(1-methylpropyl) phosphorofluoridate
IUPAC
2-[butan-2-yloxy(fluoro)phosphoryl]oxybutane
English name
Fluorophosphonic acid di-sec-butyl ester
Molecular formula
C8H18FO3P
Molecular weight
212.2

Names & synonyms

625-17-2RefChem:1079901Bis(1-methylpropyl) phosphorofluoridateDi-sec-butyl fluorophosphateDi-sec-butyl fluorophosphonateT-1835TL 1266BRN 1707340Phosphorofluoridic acid, di-sec-butyl ester3-01-00-01534 (Beilstein Handbook Reference)Dibutan-2-yl phosphorofluoridateDTXSID40978092
Show more names
TL-1266Fluorophosphonic acid di-sec-butyl esterFluoridophosphoric acid di-sec-butyl esterFluoridophosphoric acid bis(1-methylpropyl) esterPhosphorofluoridic acid, bis(1-methylpropyl) ester
Di(butan-2-yl) phosphorofluoridate

Database identifiers

CAS
625-17-2
PubChem CID
102452
DTXSID
DTXSID40978092
Nikkaji
J50.445I

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
13
Formal charge
0
Complexity
170

Related reactions

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Compound notes

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