Home Other Building Blocks 1-Chloroadamantane

1-Chloroadamantane

CAS No.:
935-56-8
Catalog Number:
AG003E8H
Molecular Formula:
C10H15Cl
Molecular Weight:
170.6791
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(GC)
1 week
United States
$99
- +
25g
>98.0%(GC)
1 week
United States
$213
- +
Product Description
Catalog Number:
AG003E8H
Chemical Name:
1-Chloroadamantane
CAS Number:
935-56-8
Molecular Formula:
C10H15Cl
Molecular Weight:
170.6791
MDL Number:
MFCD00075627
IUPAC Name:
1-chloroadamantane
InChI:
InChI=1S/C10H15Cl/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2
InChI Key:
OZNXTQSXSHODFR-UHFFFAOYSA-N
SMILES:
ClC12CC3CC(C2)CC(C1)C3
EC Number:
213-305-0
NSC Number:
143629
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.086g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.68g/mol
Monoisotopic Mass:
170.086g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
Use of Linear Free Energy Relationships (LFERs) to elucidate the mechanisms of reaction of a γ-methyl-β-alkynyl and an ortho-substituted aryl chloroformate ester. International journal of molecular sciences 20120101
Correlation of the rates of solvolysis of neopentyl chloroformate-a recommended protecting agent. International journal of molecular sciences 20110101
Correlation of the rates of solvolysis of i-butyl fluoroformate and a consideration of leaving-group effects. International journal of molecular sciences 20110101
Alpha-relaxation dynamics of orientanionally disordered mixed crystals composed of Cl-adamantane and CN-adamantane. The Journal of chemical physics 20100428
Analysis of the nucleophilic solvation effects in isopropyl chlorothioformate solvolysis. International journal of molecular sciences 20100101
Chemoselective and biomimetic hydroxylation of hydrocarbons by non-heme micro-oxo-bridged diiron(III) catalysts using m-CPBA as oxidant. Dalton transactions (Cambridge, England : 2003) 20090714
[1-(1-Adamantylamino)ethyl-idene]oxonium methane-sulfonate. Acta crystallographica. Section E, Structure reports online 20090601
Grunwald-Winstein analysis: isopropyl chloroformate solvolysis revisited. International journal of molecular sciences 20090301
Corrrelation of the specific rates of solvolysis of ethyl fluoroformate using the extended Grunwald-Winstein equation. International journal of molecular sciences 20090301
Correlation of the rates of solvolysis of two arenesulfonyl chlorides and of trans-beta-styrenesulfonyl chloride - precursors in the development of new pharmaceuticals. International journal of molecular sciences 20081201
Extended Grunwald-Winstein analysis - LFER used to gauge solvent effects in p-nitrophenyl chloroformate solvolysis. International journal of molecular sciences 20081101
The influence of carbon-carbon multiple bonds on the solvolyses of tertiary alkyl halides: A Grunwald-Winstein analysis. International journal of molecular sciences 20080901
Concerted solvent processes for common sulfonyl chloride precursors used in the synthesis of sulfonamide-based drugs. International journal of molecular sciences 20080501
Relaxation dynamics of orientationally disordered plastic crystals: effect of dopants. The journal of physical chemistry. B 20080214
Evidence for different types of water participation in the solvolysis of 1-adamantyl, tert-butyl, and methyl chlorides from density functional theory computations. The Journal of organic chemistry 20051209
Nuclear magnetic resonance and dielectric investigations of molecular motions in a glassy crystal: the mixed compound (CN-adm)0.75(Cl-adm)0.25. The Journal of chemical physics 20050115
An unusual zwitterionic, diradical intermediate in photochemical electron-transfer substitution reactions. Journal of the American Chemical Society 20041013
Solvolysis-decomposition of 2-adamantyl chloroformate: evidence for two reaction pathways. The Journal of organic chemistry 20030502
The carbene fragmentation-ring expansion route to bridgehead carbocations. Organic letters 20020711
Is the tert-butyl chloride solvolysis the most misunderstood reaction in organic chemistry? Evidence against nucleophilic solvent participation in the tert-butyl chloride transition state and for increased hydrogen bond donation to the 1-adamantyl chloride solvolysis transition state. Journal of the American Chemical Society 20011107
Is there something of mode coupling theory in orientationally disordered crystals? Physical review letters 20010716
A high pressure FT-IR spectroscopic study of phase transitions in 1-chloro- and 1-bromoadamantane. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20010401
Properties