3-Methyl-2-heptanone
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3-Methyl-2-heptanone
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CAS No:
2371-19-9
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Formula:
C8H16O
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Chemical Name:
3-Methyl-2-heptanone
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Synonyms:
2-Heptanone,3-methyl-;3-Methyl-2-heptanone;NSC 66573;95342-83-9
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CAS No:
Characteristics
17.07000
2.40170
1.438 g/cm3 @ Temp: 20 °C
-32.24°C (estimate)
164 °C
44.6ºC
1.409
1.74mmHg at 25°C
Safety Information
|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:128.21
XLogP3:2.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:128.120115130
Monoisotopic Mass:128.120115130
Topological Polar Surface Area:17.1
Heavy Atom Count:9
Complexity:86.6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes