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1-(1,3-Benzodioxol-5-yl)-2-bromoethanone

1-(1,3-Benzodioxol-5-yl)-2-bromoethanone structure

CAS No:
40288-65-1
Formula:
C9H7BrO3
Chemical Name:
1-(1,3-Benzodioxol-5-yl)-2-bromoethanone
Synonyms:
Ethanone,1-(1,3-benzodioxol-5-yl)-2-bromo-;1-(1,3-Benzodioxol-5-yl)-2-bromoethanone;2-Bromo-3′,4′-(methylenedioxy)acetophenone;3,4-Methylenedioxyphenacyl bromide;α-Bromo-3,4-methylenedioxyacetophenone;1-(1,3-Benzodioxol-5-yl)-2-bromoethan-1-one;NSC 53941;1-(Benzodioxol-5-yl)-2-bromoethanone;1-Benzo[1,3]dioxol-5-yl-2-bromoethanone;1-(Bromoacetyl)-3,4-methylenedioxybenzene;2-Bromo-1-(1,3-benzodioxol-5-yl)ethanone;5-(Bromoacetyl)-1,3-benzodioxolane;1-(Benzo[d][1,3]dioxol-5-yl)-2-bromoethanone;1-(2H-1,3-Benzodioxol-5-yl)-2-bromoethan-1-one;1-(1,3-Dioxaindan-5-yl)-2-bromoethan-1-one;2-Bromo-1-(benzo[1,3]dioxol-5-yl)-1-ethanone

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1-(1,3-Benzodioxol-5-yl)-2-bromoethanone Basic Attributes

Molecular Weight：

243.05

Exact Mass：

243.05

NSC Number：

53941

DSSTox ID：

DTXSID30288051

HScode：

2932999099

Characteristics

PSA：

35.5

XLogP3：

1.99290

Density：

1.672g/cm3

Melting Point：

86-87 °C

Boiling Point：

343.5ºC at 760 mmHg

Flash Point：

161.5ºC

Refractive Index：

1.606

Safety Information

Hazard category：

IRRITANT

Transport codes：

3261

hazard class code：

safety instructions：

26-36/37/39

Marks：

Hazard note：

Irritant

GHS Classification：

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:243.05
XLogP3:2.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:241.95786
Monoisotopic Mass:241.95786
Topological Polar Surface Area:35.5
Heavy Atom Count:13
Complexity:207
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(1,3-Benzodioxol-5-yl)-2-bromoethanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-(1,3-Benzodioxol-5-yl)-2-bromoethanone

SDS

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