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1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1,6-heptanedione

1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1,6-heptanedione structure

CAS No:
898772-68-4
Formula:
C14H18O4S
Chemical Name:
1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1,6-heptanedione
Synonyms:
1,6-Heptanedione,1-[5-(1,3-dioxolan-2-yl)-2-thienyl]-;1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1,6-heptanedione

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1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1,6-heptanedione Basic Attributes

Molecular Weight：

282.35500

Exact Mass：

282.36

DSSTox ID：

DTXSID50641902

HScode：

2934999090

Characteristics

PSA：

80.84000

XLogP3：

3.12560

Density：

1.198g/cm3

Boiling Point：

486.2ºC

Flash Point：

247.8ºC

Refractive Index：

1.532

Computed Properties

Molecular Weight:282.36
XLogP3:1.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:282.09258022
Monoisotopic Mass:282.09258022
Topological Polar Surface Area:80.8
Heavy Atom Count:19
Complexity:325
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[5-(1,3-Dioxolan-2-yl)-2-thienyl]-1,6-heptanedione

Basic Attributes
Characteristics
Computed Properties

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