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1,1,1,5,5,6,6,6-octafluorohexane-2,4-dione

1,1,1,5,5,6,6,6-octafluorohexane-2,4-dione structure

CAS No:
20825-07-4
Formula:
C6H2F8O2
Chemical Name:
1,1,1,5,5,6,6,6-octafluorohexane-2,4-dione
Synonyms:
1,1,1,5,5,6,6,6-octafluoro-2,4-hexanedione; 1,1,1,2,2,6,6,6-octafluoro-3,5-hexanedione; 3,3-dihydroperfluorohexane-2,4-dione; 3H,3H-Octafluorohexane-2,4-dione; 3H,3H-Perfluorohexane-2,4-dione;
Categories:
Organic Chemistry > Coordination Complexes

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1,1,1,5,5,6,6,6-octafluorohexane-2,4-dione Basic Attributes

Molecular Weight：

258.06600

Exact Mass：

257.99270460 g/mol

DSSTox ID：

DTXSID90174941

HScode：

2914700090

Characteristics

PSA：

34.14000

XLogP3：

2.27460

Appearance：

clear yellowish liquid

Density：

1.538 g/mL at 25ºC(lit.)

Boiling Point：

118.7ºC at 760 mmHg

Flash Point：

37.9ºC

Refractive Index：

n20/D 1.3269(lit.)

Vapor Pressure：

16.5mmHg at 25°C

Safety Information

Transport codes：

UN 3265

hazard class code：

R20/21/22

safety instructions：

S26; S36

Marks：

Xn; Xi

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:258.07
XLogP3:2.7
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:3
Exact Mass:257.99270460
Monoisotopic Mass:257.99270460
Topological Polar Surface Area:34.1
Heavy Atom Count:16
Complexity:299
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 20825-07-4

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Guide of 1,1,1,5,5,6,6,6-octafluorohexane-2,4-dione

Basic Attributes
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