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Benzenediazonium, 4-(diethylamino)-2-ethoxy-, hexafluorophosphate(1-) (1:1)

HCID 110227
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Basic information

CAS
68413-86-5
Standard SMILES
CCOc1cc(N(CC)CC)ccc1[N+]#N.F[P-](F)(F)(F)(F)F
InChIKey
FDLDJYIQUMDJDF-UHFFFAOYSA-N
Molecular formula
C12H18F6N3OP
Average molar mass
365.25 g/mol
Monoisotopic mass
365.10916818

Names & identifiers

Preferred name
Benzenediazonium, 4-(diethylamino)-2-ethoxy-, hexafluorophosphate(1-) (1:1)
IUPAC
4-(diethylamino)-2-ethoxybenzenediazonium hexafluorophosphate
English name
4-(diethylamino)-2-ethoxybenzenediazonium hexafluorophosphate
Molecular formula
C12H18F6N3OP
Molecular weight
365.2550002

Names & synonyms

68413-86-5Benzenediazonium, 4-(diethylamino)-2-ethoxy-, hexafluorophosphate(1-)EINECS 270-257-3DTXSID7071525Benzenediazonium, 4-(diethylamino)-2-ethoxy-, hexafluorophosphate(1-) (1:1)RefChem:117521DTXCID80459854-(Diethylamino)-2-ethoxybenzenediazonium hexafluorophosphateD2X7992CXCFDLDJYIQUMDJDF-UHFFFAOYSA-NNS000909784-(Diethylamino)-2-ethoxybenzene-1-diazonium hexafluoridophosphate(1-)
Show more names
Benzenediazonium, 4-(diethylamino)-2-ethoxy-, hexafluorophosphate(1-) (1:1) (ACI)

Database identifiers

CAS
68413-86-5
PubChem CID
110227
DTXSID
DTXSID7071525
UNII
D2X7992CXC
EC Number
270-257-3

Properties

Computed structural properties

Topological polar surface area
40.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
5
Heavy atoms
23
Formal charge
0
Complexity
307

Physicochemical properties

EPA Substance Registry System
4 · Benzenediazonium, 4-(diethylamino)-2-ethoxy-, hexafluorophosphate(1-) (68413-86-5)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzenediazonium, 4-(diethylamino)-2-ethoxy-, hexafluorophosphate(1-) (1:1): INACTIVE

Related reactions

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Compound notes

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