2,4-DIMETHYL-1-PENTANOL
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2,4-DIMETHYL-1-PENTANOL
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CAS No:
6305-71-1
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Formula:
C7H16O
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Chemical Name:
2,4-DIMETHYL-1-PENTANOL
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Synonyms:
2,4-DIMETHYL-1-PENTANOL;2,4-dimethylpentan-1-ol;NSC 41179;AI3-38565;1-Pentanol, 2,4-dimethyl- (8CI)(9CI);2,4-dimethyl-pentan-1-ol;1-Pentanol,2,4-dimethyl-;SCHEMBL358259;CTK5B7322;DTXSID50875705
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CAS No:
Characteristics
20.23000
2.10
0.8±0.1 g/cm3
-30.45°C (estimate)
161.0±0.0 °C at 760 mmHg
51.6±8.7 °C
1.419
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:116.20
XLogP3:2
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:50.3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes