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3,3,4,4,4-Pentafluoro-2-butanone

3,3,4,4,4-Pentafluoro-2-butanone structure

CAS No:
374-41-4
Formula:
C4H3F5O
Chemical Name:
3,3,4,4,4-Pentafluoro-2-butanone
Synonyms:
2-Butanone,3,3,4,4,4-pentafluoro-;3,3,4,4,4-Pentafluoro-2-butanone;Pentafluoroethyl methyl ketone;NSC 42726
Categories:
Organic Chemistry > Coordination Complexes

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3,3,4,4,4-Pentafluoro-2-butanone Basic Attributes

Molecular Weight：

162.059

Exact Mass：

162.06

NSC Number：

42726

DSSTox ID：

DTXSID90285748

HScode：

2914700090

Characteristics

PSA：

17.1

XLogP3：

1.77300

Density：

1.284 g/cm³ @ Temp: 20 °C

Boiling Point：

39.5-40 °C

Refractive Index：

1.286

Safety Information

Transport codes：

UN 1224

hazard class code：

R10

safety instructions：

S16

Marks：

Xi: Irritant;

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Danger|H225 (33.33%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:162.06
XLogP3:1.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:162.01040553
Monoisotopic Mass:162.01040553
Topological Polar Surface Area:17.1
Heavy Atom Count:10
Complexity:146
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 374-41-4

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Guide of 3,3,4,4,4-Pentafluoro-2-butanone

Basic Attributes
Characteristics
Safety Information
Computed Properties
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3,3,4,4,4-Pentafluoro-2-butanone

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