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4-Chloro-2-methyl-3-butyn-2-ol

4-Chloro-2-methyl-3-butyn-2-ol structure

CAS No:
29552-15-6
Formula:
C5H7ClO
Chemical Name:
4-Chloro-2-methyl-3-butyn-2-ol
Synonyms:
3-Butyn-2-ol,4-chloro-2-methyl-;4-Chloro-2-methyl-3-butyn-2-ol;2-Methyl-4-chloro-3-butyn-2-ol;Dimethyl(chloroethynyl)carbinol;3-Chloro-1,1-dimethyl-2-propyn-1-ol;1-Chloro-3-hydroxy-3-methyl-1-butyne

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4-Chloro-2-methyl-3-butyn-2-ol Basic Attributes

Molecular Weight：

118.56

Exact Mass：

118.56

DSSTox ID：

DTXSID10183737

Characteristics

PSA：

20.2 Å²

Density：

1.147±0.06 g/cm3

Melting Point：

80-83 °C

Boiling Point：

100 °C

PKA：

12.31±0.29

Computed Properties

Molecular Weight:118.56
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:118.0185425
Monoisotopic Mass:118.0185425
Topological Polar Surface Area:20.2
Heavy Atom Count:7
Complexity:115
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Chloro-2-methyl-3-butyn-2-ol

Basic Attributes
Characteristics
Computed Properties

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