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3-Heptadecylcatechol

3-Heptadecylcatechol structure

CAS No:
5862-27-1
Formula:
C23H40O2
Chemical Name:
3-Heptadecylcatechol
Synonyms:
1,2-Benzenediol,3-heptadecyl-;Pyrocatechol,3-heptadecyl-;3-Heptadecyl-1,2-benzenediol;3-Heptadecylcatechol

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Description

3-heptadecylcatechol is catechol substituted at position 3 with a heptadecyl group.

3-Heptadecylcatechol Basic Attributes

Molecular Weight：

348.6 g/mol

Exact Mass：

348.56

UNII：

29R0483XLZ

DSSTox ID：

DTXSID60207331

Characteristics

PSA：

40.5 Å²

Melting Point：

62-63 °C

Drug Information

MeSH Entry Terms：

3-heptadecylcatechol

Computed Properties

Molecular Weight:348.6
XLogP3:10.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:16
Exact Mass:348.302830514
Monoisotopic Mass:348.302830514
Topological Polar Surface Area:40.5
Heavy Atom Count:25
Complexity:279
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Heptadecylcatechol

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

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