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2,2,4,6,6-Pentamethyl-4-heptanethiol

2,2,4,6,6-Pentamethyl-4-heptanethiol structure

CAS No:
93002-38-1
Formula:
C12H26S
Chemical Name:
2,2,4,6,6-Pentamethyl-4-heptanethiol
Synonyms:
4-Heptanethiol,2,2,4,6,6-pentamethyl-;2,2,4,6,6-Pentamethyl-4-heptanethiol

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2,2,4,6,6-Pentamethyl-4-heptanethiol Basic Attributes

Molecular Weight：

202.4

Exact Mass：

202.40

EC Number：

296-714-7

DSSTox ID：

DTXSID90239241

Characteristics

PSA：

XLogP3：

4.9

Density：

0.8667 g/cm³ @ Temp: 20 °C

Boiling Point：

91-92 °C @ Press: 7 Torr

Computed Properties

Molecular Weight:202.40
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:202.17552200
Monoisotopic Mass:202.17552200
Topological Polar Surface Area:1
Heavy Atom Count:13
Complexity:141
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2,4,6,6-Pentamethyl-4-heptanethiol

Basic Attributes
Characteristics
Computed Properties

2,2,4,6,6-Pentamethyl-4-heptanethiol

SDS

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