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2,2,5,6,6-pentamethylheptan-3-ol

2,2,5,6,6-pentamethylheptan-3-ol structure

CAS No:
859773-04-9
Formula:
C12H26O
Chemical Name:
2,2,5,6,6-pentamethylheptan-3-ol
Synonyms:
NSC229359;2,2,5,6,6-pentamethyl-heptan-3-ol;SCHEMBL17190157;2,2,5,6,6-pentamethyl-3-heptanol;NSC-229359;859773-04-9

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2,2,5,6,6-pentamethylheptan-3-ol Basic Attributes

Molecular Weight：

186.33 g/mol

Exact Mass：

186.198365449 g/mol

NSC Number：

229359

Characteristics

PSA：

20.2 Å²

XLogP3：

3.4657

Computed Properties

Molecular Weight:186.33
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:186.198365449
Monoisotopic Mass:186.198365449
Topological Polar Surface Area:20.2
Heavy Atom Count:13
Complexity:148
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2,5,6,6-pentamethylheptan-3-ol

Basic Attributes
Characteristics
Computed Properties

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