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CAS Number: 1260671-23-5
methyl 4-(prop-2-yn-1-yl)benzoate

Structure

methyl 4-(prop-2-yn-1-yl)benzoate
Name: methyl 4-(prop-2-yn-1-yl)benzoate
Synonyms:
General Information
Product Number: 1260671235

CAS Registry Number 1260671-23-5
Name:
Benzoic acid, 4-​(2-​propyn-​1-​yl)​-​, methyl ester
4-(2-Propynyl)benzoic acid methyl ester
Methyl 4-(prop-2-ynyl)benzoate

 

Chemical Formula: C11H10O2
Exact Mass: 174.07
Molecular Weight: 174.20
m/z: 174.07 (100.0%), 175.07 (12.1%), 176.07 (1.1%)

 

InChI:InChI=1S/C11H10O2/c1-3-4-9-5-7-10(8-6-9)11(12)13-2/h1,5-8H,4H2,2H3

InChI Key:UIPPHEYUBACMCD-UHFFFAOYSA-N

Canonical SMILES:COC(=O)C1=CC=C(C=C1)CC#C

Specification

98%

References

PCT Int. Appl. (2011), WO 2011083278 A1 20110714.

PCT Int. Appl. (2011), WO 2011030068 A1 20110317.                                  

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