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2-Methyl-4-pentyn-2-ol

2-Methyl-4-pentyn-2-ol structure

CAS No:
590-37-4
Formula:
C6H10O
Chemical Name:
2-Methyl-4-pentyn-2-ol
Synonyms:
4-Pentyn-2-ol,2-methyl-;2-Methyl-4-pentyn-2-ol;2-Methylpent-4-yn-2-ol;2-Methyl-4-pentyne-2-ol;4-Methyl-1-pentyne-4-ol;4-Methyl-1-pentyn-4-ol;NSC 35151

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2-Methyl-4-pentyn-2-ol Basic Attributes

Molecular Weight：

98.14300

Exact Mass：

98.14

NSC Number：

35151

DSSTox ID：

DTXSID20284047

Characteristics

PSA：

20.23000

XLogP3：

0.78060

Density：

0.901g/cm3

Boiling Point：

124-127 °C @ Press: 756 Torr

Flash Point：

65.2ºC

Refractive Index：

1.448

Safety Information

GHS Classification：

|Warning|H227 (100%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P271, P280, P302+P352, 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:98.14
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:98.073164938
Monoisotopic Mass:98.073164938
Topological Polar Surface Area:20.2
Heavy Atom Count:7
Complexity:94
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

34761-53-0

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Guide of 2-Methyl-4-pentyn-2-ol

Basic Attributes
Characteristics
Safety Information
Computed Properties
Synthesis Route

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