4-Methyl-3-hexanol
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4-Methyl-3-hexanol
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CAS No:
615-29-2
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Formula:
C7H16O
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Chemical Name:
4-Methyl-3-hexanol
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Synonyms:
3-Hexanol,4-methyl-;3-Pentanol,2-ethyl-;4-Methyl-3-hexanol;4-Methylhexan-3-ol;2-Ethyl-3-pentanol;3-Methyl-4-hexanol;NSC 91500;1,3-Dimethyl-2-pentanol
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CAS No:
Characteristics
20.23000
1.80340
0.8231 g/cm3 @ Temp: 20 °C
-30.45°C (estimate)
64 °C @ Press: 15 Torr
51.6ºC
1.418
Safety Information
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, P501
H226
|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:116.20
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:116.120115130
Monoisotopic Mass:116.120115130
Topological Polar Surface Area:20.2
Heavy Atom Count:8
Complexity:52.3
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes