Home Carboxys 2-(prop-2-yn-1-yl)oxolane-2-carboxylic acid

2-(prop-2-yn-1-yl)oxolane-2-carboxylic acid

CAS No.:
1936666-75-9
Catalog Number:
AG01EMT8
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
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Product Description
Catalog Number:
AG01EMT8
Chemical Name:
2-(prop-2-yn-1-yl)oxolane-2-carboxylic acid
CAS Number:
1936666-75-9
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
MDL Number:
MFCD29494842
IUPAC Name:
2-prop-2-ynyloxolane-2-carboxylic acid
InChI:
InChI=1S/C8H10O3/c1-2-4-8(7(9)10)5-3-6-11-8/h1H,3-6H2,(H,9,10)
InChI Key:
MDFNKHNLBNSJLV-UHFFFAOYSA-N
SMILES:
C#CCC1(CCCO1)C(=O)O
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.063g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.165g/mol
Monoisotopic Mass:
154.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties