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2-ACETYLDIMEDONE

2-ACETYLDIMEDONE structure

CAS No:
1755-15-3
Formula:
C10H14O3
Chemical Name:
2-ACETYLDIMEDONE
Synonyms:
2-ACETYLDIMEDONE;2-ACETYL-5,5-DIMETHYL-1,3-CYCLOHEXANEDIONE;2-ACETYL-5,5-DIMETHYL-CYCLOHEXAN-1,3-DIONE;2-ACETYL-5,5-DIMETHYL-CYCLOHEXANE-1,3-DIONE;DIMETHYL-2,6-DIOXOCYCLOHEXYLIDENE ETHYL ALCOHOL;DDE-OH;DDE;1,3-Cyclohexanedione, 2-acetyl-5,5-dimethyl-

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2-ACETYLDIMEDONE Basic Attributes

Molecular Weight：

182.22

Exact Mass：

182.094299

DSSTox ID：

DTXSID50334029

HScode：

2914299000

Characteristics

PSA：

51.2

XLogP3：

0.27

Density：

1.077±0.06 g/cm3(Predicted)

Melting Point：

36 °C

Boiling Point：

132-133 °C

Flash Point：

128.8±20.3 °C

Refractive Index：

1.462

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-ACETYLDIMEDONE Use and Manufacturing

Reagent for the introduction of Dde group.

Computed Properties

Molecular Weight:182.22
XLogP3:0.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:182.094294304
Monoisotopic Mass:182.094294304
Topological Polar Surface Area:51.2
Heavy Atom Count:13
Complexity:256
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-ACETYLDIMEDONE

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

2-ACETYLDIMEDONE

SDS

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