Home Other Building Blocks [4-(prop-2-yn-1-yloxy)cyclohexyl]methanol, Mixture of diastereomers

[4-(prop-2-yn-1-yloxy)cyclohexyl]methanol, Mixture of diastereomers

CAS No.:
1692498-55-7
Catalog Number:
AG01BEP7
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
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Product Description
Catalog Number:
AG01BEP7
Chemical Name:
[4-(prop-2-yn-1-yloxy)cyclohexyl]methanol, Mixture of diastereomers
CAS Number:
1692498-55-7
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
MDL Number:
MFCD28118387
IUPAC Name:
(4-prop-2-ynoxycyclohexyl)methanol
InChI:
InChI=1S/C10H16O2/c1-2-7-12-10-5-3-9(8-11)4-6-10/h1,9-11H,3-8H2
InChI Key:
JFJNULVYUNJHIH-UHFFFAOYSA-N
SMILES:
OCC1CCC(CC1)OCC#C
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties