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1-Adamantanecarbonyl chloride

1-Adamantanecarbonyl chloride structure

1-Adamantanecarbonyl chloride 

structure
  • CAS No:

    2094-72-6

  • Formula:

    C11H15ClO

  • Chemical Name:

    1-Adamantanecarbonyl chloride

  • Synonyms:

    Tricyclo[3.3.1.13,7]decane-1-carbonyl chloride;1-Adamantanecarbonyl chloride;1-Adamantanecarboxylic acid chloride;1-Adamantylcarbonyl chloride;1-Adamantoyl chloride;1-Adamantylcarboxylic acid chloride;1-Adamantanoyl chloride;NSC 179368;NSC 249324;1-Chlorocarbonyladamantane

  • Categories:

    Organic Chemistry  >  Carboxylic Acids and Derivatives

Description

White to almost white crystalline solid

1-Adamantanecarbonyl chloride Basic Attributes

198.69

198.69

389960

218-252-7

179368|249324

DTXSID20175108

2915900090

Characteristics

17.1

3.6

White to almost white Crystalline Solid

1.2±0.1 g/cm3

48.5-52.0 °C

140 °C @ Press: 15 Torr

>230 °F

1.556

H2O: may decompose

2-8°C

0.00678mmHg at 25°C

Safety Information

8

UN 3261 8/PG 2

3

14-34-37

26-36/37/39-45-24/25

C

Stable under normal temperatures and pressures.

P280-P305 + P351 + P338-P310

H314

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 47 companies from 6 notifications to the ECHA C&L Inventory.

Drug Information

1-adamantanecarbonyl chloride

Computed Properties

Molecular Weight:198.69
XLogP3:3.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:198.0811428
Monoisotopic Mass:198.0811428
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:218
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

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