Home Carboxys 3-(prop-2-yn-1-yl)oxolane-3-carboxylic acid

3-(prop-2-yn-1-yl)oxolane-3-carboxylic acid

CAS No.:
1526588-44-2
Catalog Number:
AG01EMRT
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
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Product Description
Catalog Number:
AG01EMRT
Chemical Name:
3-(prop-2-yn-1-yl)oxolane-3-carboxylic acid
CAS Number:
1526588-44-2
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
MDL Number:
MFCD21921387
IUPAC Name:
3-prop-2-ynyloxolane-3-carboxylic acid
InChI:
InChI=1S/C8H10O3/c1-2-3-8(7(9)10)4-5-11-6-8/h1H,3-6H2,(H,9,10)
InChI Key:
NPVOTZROLTXESN-UHFFFAOYSA-N
SMILES:
C#CCC1(COCC1)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:
0.1  
Properties