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1,1,1,3,3-Pentachloro-2-propanone

1,1,1,3,3-Pentachloro-2-propanone structure

CAS No:
1768-31-6
Formula:
C3HCl5O
Chemical Name:
1,1,1,3,3-Pentachloro-2-propanone
Synonyms:
2-Propanone,1,1,1,3,3-pentachloro-;2-Propanone,pentachloro-;1,1,1,3,3-Pentachloro-2-propanone;Pentachloroacetone;1,1,1,3,3-Pentachloropropanone;Pentachloro-2-propanone

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1,1,1,3,3-Pentachloro-2-propanone Basic Attributes

Molecular Weight：

230.3 g/mol

Exact Mass：

230.30

EC Number：

217-188-7

UNII：

Y0120057FS

DSSTox ID：

DTXSID7021651

Characteristics

PSA：

17.1 Å²

Density：

1.6601 g/cm³ @ Temp: 20 °C

Melting Point：

2.1 °C

Boiling Point：

97.5-98.5 °C @ Press: 40 Torr

Safety Information

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P260, P264, P270, P271, P284, P301+P310, P304+P340, P310, P320, P321, P330, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1,1,1,3,3-pentachloroacetone

Computed Properties

Molecular Weight:230.3
XLogP3:3.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:229.844053
Monoisotopic Mass:227.847003
Topological Polar Surface Area:17.1
Heavy Atom Count:9
Complexity:114
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,1,1,3,3-Pentachloro-2-propanone

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

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