(1-ethynylcyclohexyl) 4-nitrobenzoate

Modify Date: 2025-09-22 18:09:40

(1-ethynylcyclohexyl) 4-nitrobenzoate Structure
(1-ethynylcyclohexyl) 4-nitrobenzoate structure
 Common Name (1-ethynylcyclohexyl) 4-nitrobenzoate
CAS Number 36144-39-5 Molecular Weight 273.28400
Density 1.24g/cm3 Boiling Point 401.2ºC at 760 mmHg
Molecular Formula C15H15NO4 Melting Point N/A
MSDS N/A Flash Point 166.3ºC

 Names

Name (1-ethynylcyclohexyl) 4-nitrobenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.24g/cm3
Boiling Point 401.2ºC at 760 mmHg
Molecular Formula C15H15NO4
Molecular Weight 273.28400
Flash Point 166.3ºC
Exact Mass 273.10000
PSA 72.12000
LogP 3.61090
Index of Refraction 1.571
InChIKey BPYBIIHGHNSCFS-UHFFFAOYSA-N
SMILES C#CC1(OC(=O)c2ccc([N+](=O)[O-])cc2)CCCCC1

 Synthetic Route

1-Ethynyl-1-cyclohexanol structure

1-Ethynyl-1-cyc...

CAS#:78-27-3

4-Nitrobenzoyl chloride structure

4-Nitrobenzoyl ...

CAS#:122-04-3

~94%

(1-ethynylcyclohexyl) 4-nitrobenzoate Structure

(1-ethynylcyclo...

CAS#:36144-39-5

Literature: Gomez-Vidal; Forrester; Silverman Organic letters, 2001 , vol. 3, # 16 p. 2477 - 2479

 Synonyms

1-ethynylcyclohexyl 4-nitrobenzoate
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