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4-Isoamylresorcinol

4-Isoamylresorcinol structure

CAS No:
15116-17-3
Formula:
C11H16O2
Chemical Name:
4-Isoamylresorcinol
Synonyms:
1,3-Benzenediol,4-(3-methylbutyl)-;Resorcinol,4-isopentyl-;4-(3-Methylbutyl)-1,3-benzenediol;4-Isopentyl resorcinol;4-Isoamylresorcinol;NKO 9

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4-Isoamylresorcinol Basic Attributes

Molecular Weight：

180.24 g/mol

Exact Mass：

180.24

DSSTox ID：

DTXSID50164722

Characteristics

PSA：

40.5 Å²

Melting Point：

68 °C

Boiling Point：

155-158 °C @ Press: 12 Torr

Computed Properties

Molecular Weight:180.24
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:180.115029749
Monoisotopic Mass:180.115029749
Topological Polar Surface Area:40.5
Heavy Atom Count:13
Complexity:145
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Isoamylresorcinol

Basic Attributes
Characteristics
Computed Properties

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