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4-METHYL-2-HEPTYN-4-OL

4-METHYL-2-HEPTYN-4-OL structure

CAS No:
4376-16-3
Formula:
C8H14O
Chemical Name:
4-METHYL-2-HEPTYN-4-OL
Synonyms:
4-Methyl-2-heptyn-4-ol;4-methylhept-2-yn-4-ol;SCHEMBL932689;CTK4I7714;DTXSID60339681;AKOS006227655;FT-0619006

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4-METHYL-2-HEPTYN-4-OL Basic Attributes

Molecular Weight：

126.19600

Exact Mass：

126.10400

DSSTox ID：

DTXSID60339681

HScode：

2905290000

Characteristics

PSA：

20.23000

XLogP3：

1.56080

Density：

0.892g/cm3

Boiling Point：

153.1ºC at 760 mmHg

Flash Point：

52.1ºC

Refractive Index：

1.458

Safety Information

hazard class code：

R10

safety instructions：

S23-S24/25

Computed Properties

Molecular Weight:126.20
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:126.104465066
Monoisotopic Mass:126.104465066
Topological Polar Surface Area:20.2
Heavy Atom Count:9
Complexity:137
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-METHYL-2-HEPTYN-4-OL

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-METHYL-2-HEPTYN-4-OL

SDS

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