ChemicalBook--->CAS DataBase List--->2094-72-6

2094-72-6

2094-72-6 Structure

2094-72-6 Structure
IdentificationMore
[Name]

1-Adamantanecarbonyl chloride
[CAS]

2094-72-6
[Synonyms]

1-ADAMANTANECARBONYL CHLORIDE
1-ADAMANTANECARBOXYLIC ACID CHLORIDE
1-ADAMANTANECARBOXYLIC ACID CHLOROANHYDRIDE
ADAMANTANE-1-CARBONYL CHLORIDE
AKOS BC-0659
TRICYCLO[3.3.1.1]DECANE-1-CARBOXYLIC ACID CHLORIDE
1-Adamantanoic acid chloride
1-Adamantoyl chloride
1-Adamantyl carbonyl chloride
Adamantane-1-carboxylic acid chloride
Adamantanecarbonyl chloride
Adamantoyl chloride
Adamantyl chloroformate
Tricyclo[3.3.1.1(3,7)-]decane-1-carbonyl chloride
1-Adamantanecarbony chloride
38. 1-adamantanecarbonyl chloride
[EINECS(EC#)]

218-252-7
[Molecular Formula]

C11H15ClO
[MDL Number]

MFCD00074724
[Molecular Weight]

198.69
[MOL File]

2094-72-6.mol
Chemical PropertiesBack Directory
[Appearance]

White to almost white crystalline solid
[Melting point ]

49-51 °C(lit.)
[Boiling point ]

135-136 °C10 mm Hg(lit.)
[density ]

1.0490 (rough estimate)
[refractive index ]

1.5364 (estimate)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

soluble in Toluene
[form ]

Crystalline Solid
[color ]

White to almost white
[Water Solubility ]

may decompose
[Sensitive ]

Moisture Sensitive
[BRN ]

389960
[InChI]

1S/C11H15ClO/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2/t7-,8+,9-,11-
[InChIKey]

MIBQYWIOHFTKHD-KJZNFTALSA-N
[SMILES]

ClC(=O)C12C[C@H]3C[C@H](C[C@H](C3)C1)C2
[CAS DataBase Reference]

2094-72-6(CAS DataBase Reference)
[NIST Chemistry Reference]

1-Adamantanecarboxlic acid chloride(2094-72-6)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P260-P280-P301+P330+P331-P303+P361+P353-P305+P351+P338
[Hazard Codes ]

C
[Risk Statements ]

R14:Reacts violently with water.
R34:Causes burns.
R37:Irritating to the respiratory system.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S24/25:Avoid contact with skin and eyes .
[RIDADR ]

UN 3261 8/PG 2
[WGK Germany ]

3
[F ]

10-21
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29162090
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Skin Corr. 1B
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Dichloromethane-->Thionyl chloride-->1-Adamantanecarboxylic acid
[Preparation Products]

2-(1-Adamantyl)propan-2-ol-->1-Adamantyl isothiocyanate-->1-(1-Adamantyl)propan-1-ol-->Ethyl adamantane-1-carboxylate-->1-Adamantanecarboxamide-->Adamantane-1-carboxylic acid methyl ester-->3-[(1-Adamantylcarbonyl)amino]propanoic acid-->1-Adamantyl(phenyl)methanone
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1-Adamantanecarbonyl chloride(2094-72-6).msds
Hazard InformationBack Directory
[Chemical Properties]

White to almost white crystalline solid
[Uses]

1-Adamantanecarbonyl chloride was used in the preparation of efficient amine-modified oligodeoxynucleotides for fabrication of DNA microarrays.
[General Description]

1-Adamantanecarbonyl chloride on reaction with triethylammonium isopropylphosphite forms mixed anhydride, an efficient capping reagent for the hydrogen-phosphonate DNA synthesis. It is a good substrate for Friedel–Crafts acylation of anisole in the presence of indium metal.
Spectrum DetailBack Directory
[Spectrum Detail]

1-Adamantanecarbonyl chloride(2094-72-6)MS
1-Adamantanecarbonyl chloride(2094-72-6)13CNMR
1-Adamantanecarbonyl chloride(2094-72-6)IR1
1-Adamantanecarbonyl chloride(2094-72-6)IR2
1-Adamantanecarbonyl chloride(2094-72-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Adamantanecarboxylic acid chloride, 97%(2094-72-6)
[Alfa Aesar]

Adamantane-1-carbonyl chloride, 97%(2094-72-6)
[Sigma Aldrich]

2094-72-6(sigmaaldrich)
[TCI AMERICA]

1-Adamantanecarbonyl Chloride,>97.0%(GC)(T)(2094-72-6)
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