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Pentafluorobenzaldehyde

Pentafluorobenzaldehyde structure

CAS No:
653-37-2
Formula:
C7HF5O
Chemical Name:
Pentafluorobenzaldehyde
Synonyms:
Benzaldehyde,2,3,4,5,6-pentafluoro-;Benzaldehyde,pentafluoro-;2,3,4,5,6-Pentafluorobenzaldehyde;Pentafluorobenzaldehyde;Perfluorobenzaldehyde;Formylpentafluorobenzene;NSC 96967
Categories:
Organic Chemistry > Organic Fluorine Compound

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Description

CLEAR YELLOWISH LIQUID AFTER MELTING

Pentafluorobenzaldehyde Basic Attributes

Molecular Weight：

196.07

Exact Mass：

196.07

BRN：

1876550

EC Number：

211-502-6

UNII：

S9YIE3JZ4K

NSC Number：

96967

DSSTox ID：

DTXSID4022101

HScode：

2913000090

Characteristics

PSA：

17.1

XLogP3：

2.23

Appearance：

Clear yellow Liquid After Melting

Density：

1.6±0.1 g/cm3

Melting Point：

20 °C

Boiling Point：

167 °C

Flash Point：

172 °F

Refractive Index：

1.452

Water Solubility：

Sparingly soluble in water (0.027 g/L at 25°C).

Storage Conditions：

2-8°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2810 6.1/PG 3

wgk germany：

hazard class code：

20/22-36/37/38-20

safety instructions：

26-37/39

RTECS Number：

CU7542000

Marks：

Xn,F,Xi

Hazard note：

Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H332-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 47 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

pentafluorobenzaldehyde

Pentafluorobenzaldehyde Use and Manufacturing

Derivatization reagent

Computed Properties

Molecular Weight:196.07
XLogP3:1.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:195.99475546
Monoisotopic Mass:195.99475546
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:183
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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