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3,5-ditert-butyloxepine-2,7-dione

3,5-ditert-butyloxepine-2,7-dione structure

CAS No:
24289-60-9
Formula:
C14H20O3
Chemical Name:
3,5-ditert-butyloxepine-2,7-dione
Synonyms:
NSC331940;24289-60-9;DTXSID30318488;3,5-Di-tert-butylmuconic anhydride;ZINC1575089;2,4-di-t-butylmuconic acid anhydride;3,5-Di-tert-butyl-2,7-oxepindione;NSC-331940

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3,5-ditert-butyloxepine-2,7-dione Basic Attributes

Molecular Weight：

236.31 g/mol

Exact Mass：

236.14124450 g/mol

NSC Number：

331940

DSSTox ID：

DTXSID30318488

Characteristics

PSA：

43.4 Å²

XLogP3：

2.595

Density：

1.058g/cm3

Boiling Point：

327.8ºC at 760mmHg

Flash Point：

142ºC

Refractive Index：

1.495

Vapor Pressure：

0.000198mmHg at 25°C

Computed Properties

Molecular Weight:236.31
XLogP3:3.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:236.14124450
Monoisotopic Mass:236.14124450
Topological Polar Surface Area:43.4
Heavy Atom Count:17
Complexity:412
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

21243-82-3

22802-86-4

21243-82-3

87221-87-2

87221-88-3

22802-86-4

18261-07-9

3790-93-0

3383-21-9

Suppliers(13)

21243-82-3

Suppliers(1)

Hot Searches: dystrophic toenails; oakwood chemicals; chemical formula nitrate; dichlorine heptoxide; toluene formula; peg-40 hydrogenated castor oil

Guide of 3,5-ditert-butyloxepine-2,7-dione

Basic Attributes
Characteristics
Computed Properties
Synthesis Route

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