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1-(4-CHLORO-PHENYL)-BUTANE-1,3-DIONE

1-(4-CHLORO-PHENYL)-BUTANE-1,3-DIONE structure

CAS No:
29681-98-9
Formula:
C10H9ClO2
Chemical Name:
1-(4-CHLORO-PHENYL)-BUTANE-1,3-DIONE
Synonyms:
1-(4-CHLORO-PHENYL)-BUTANE-1,3-DIONE;1-(4-FLUOROPHENYL)-1,3-DIOXOBUTANE;1-(4-Fluorophenyl)-1,3-butanedione;1,3-Butanedione,1-(4-fluorophenyl)-;1-(4-CHLORO-PHENYL)-BUTANE-1,3-DIONE（WS204308）

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1-(4-CHLORO-PHENYL)-BUTANE-1,3-DIONE Basic Attributes

Molecular Weight：

196.63

Exact Mass：

180.058655

DSSTox ID：

DTXSID40330792

HScode：

2914700090

Characteristics

PSA：

34.14000

XLogP3：

2.57

Density：

1.2±0.1 g/cm3

Melting Point：

45.0 to 49.0 °C

Boiling Point：

117°C/4mmHg(lit.)

Flash Point：

105.5±14.6 °C

Refractive Index：

1.499

Safety Information

hazard class code：

Marks：

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:180.17
XLogP3:1.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:180.05865769
Monoisotopic Mass:180.05865769
Topological Polar Surface Area:34.1
Heavy Atom Count:13
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-CHLORO-PHENYL)-BUTANE-1,3-DIONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-(4-CHLORO-PHENYL)-BUTANE-1,3-DIONE

SDS

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