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1-ADAMANTANEACETONITRILE

1-ADAMANTANEACETONITRILE structure

CAS No:
16269-13-9
Formula:
C12H17N
Chemical Name:
1-ADAMANTANEACETONITRILE
Synonyms:
LABOTEST-BB LT00233105;IFLAB-BB F1928-0023;AKOS BB-9584;2-(1-ADAMANTYL)ACETONITRILE;1-ADAMANTANEACETONITRILE;1-ADAMANTYLACETONITRILE;TIMTEC-BB SBB001878;Tricyclo[3.3.1.13,7]decane-1-acetonitrile
Categories:
Organic Chemistry > Nitrile Compound

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1-ADAMANTANEACETONITRILE Basic Attributes

Molecular Weight：

175.27

Exact Mass：

175.136093

DSSTox ID：

DTXSID50167435

HScode：

2926909090

Characteristics

PSA：

23.8

XLogP3：

2.97

Density：

1.061±0.06 g/cm3 (20 ºC 760 Torr)

Melting Point：

Boiling Point：

295.0±9.0 °C(Predicted)

Flash Point：

137.4±3.8 °C

Refractive Index：

1.534

Water Solubility：

Sparingly soluble in water.

Vapor Pressure：

0.00157mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

3276

hazard class code：

20/21/22

safety instructions：

22-36/37

Computed Properties

Molecular Weight:175.27
XLogP3:3.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:175.136099547
Monoisotopic Mass:175.136099547
Topological Polar Surface Area:23.8
Heavy Atom Count:13
Complexity:229
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1-Adamantaneacetonitrile RC07569

Unit Price: $1 /KG EXW

CAS No.: 16269-13-9

Grade: Industrial Grade

Content: 99%

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