Home Other Building Blocks 2-ethynylcyclohexan-1-ol

2-ethynylcyclohexan-1-ol

CAS No.:
5877-41-8
Catalog Number:
AG01BF45
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
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Product Description
Catalog Number:
AG01BF45
Chemical Name:
2-ethynylcyclohexan-1-ol
CAS Number:
5877-41-8
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
MDL Number:
MFCD25965063
IUPAC Name:
2-ethynylcyclohexan-1-ol
InChI:
InChI=1S/C8H12O/c1-2-7-5-3-4-6-8(7)9/h1,7-9H,3-6H2
InChI Key:
KNVOCSQDAIHOPP-UHFFFAOYSA-N
SMILES:
C#CC1CCCCC1O
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.089g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
124.183g/mol
Monoisotopic Mass:
124.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties