Home Other Building Blocks 4-(prop-2-yn-1-yl)oxan-4-ol

4-(prop-2-yn-1-yl)oxan-4-ol

CAS No.:
1258641-47-2
Catalog Number:
AG01AAGD
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
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Product Description
Catalog Number:
AG01AAGD
Chemical Name:
4-(prop-2-yn-1-yl)oxan-4-ol
CAS Number:
1258641-47-2
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
MDL Number:
MFCD17167178
IUPAC Name:
4-prop-2-ynyloxan-4-ol
InChI:
InChI=1S/C8H12O2/c1-2-3-8(9)4-6-10-7-5-8/h1,9H,3-7H2
InChI Key:
IHPXIGYAZFZPPH-UHFFFAOYSA-N
SMILES:
C#CCC1(O)CCOCC1
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.182g/mol
Monoisotopic Mass:
140.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties