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3,3-Dimethylcyclobutanone

3,3-Dimethylcyclobutanone structure

CAS No:
1192-33-2
Formula:
C6H10O
Chemical Name:
3,3-Dimethylcyclobutanone
Synonyms:
3,3-dimethylcyclobutan-1-one;3,3-Dimethylcyclobutanone;Cyclobutanone, 3,3-dimethyl-;3,3-Dimethylcyclobutanon e;CTK0F9602;DTXSID50337772;ZINC87222723;AKOS018708209;NE31107;SB18531

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3,3-Dimethylcyclobutanone Basic Attributes

Molecular Weight：

98.14

Exact Mass：

98.07320

DSSTox ID：

DTXSID50337772

HScode：

2914299000

Characteristics

PSA：

17.07000

XLogP3：

1.37550

Density：

0.926g/cm3

Boiling Point：

124.4ºC at 760 mmHg

Flash Point：

22.4ºC

Refractive Index：

1.439

Safety Information

GHS Classification：

|Danger|H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:98.14
XLogP3:0.9
Hydrogen Bond Acceptor Count:1
Exact Mass:98.073164938
Monoisotopic Mass:98.073164938
Topological Polar Surface Area:17.1
Heavy Atom Count:7
Complexity:92.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,3-Dimethylcyclobutanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

3,3-Dimethylcyclobutanone

SDS

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