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87763-82-4

87763-82-4 | Acetic acid, methoxy-, 2-butynyl ester

CAS No: 87763-82-4 Catalog No: AG004IDH MDL No:

Product Description

Catalog Number:
AG004IDH
Chemical Name:
Acetic acid, methoxy-, 2-butynyl ester
CAS Number:
87763-82-4
Molecular Formula:
C7H10O3
Molecular Weight:
142.1525
IUPAC Name:
but-2-ynyl 2-methoxyacetate
InChI:
InChI=1S/C7H10O3/c1-3-4-5-10-7(8)6-9-2/h5-6H2,1-2H3
InChI Key:
SYIIHWMFTSXEGT-UHFFFAOYSA-N
SMILES:
COCC(=O)OCC#CC

Properties

Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.063g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.154g/mol
Monoisotopic Mass:
142.063g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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