Home Other Building Blocks 3-(methylsulfanyl)cyclohexan-1-ol, Mixture of diastereomers

3-(methylsulfanyl)cyclohexan-1-ol, Mixture of diastereomers

CAS No.:
51755-67-0
Catalog Number:
AG01C83Q
Molecular Formula:
C7H14OS
Molecular Weight:
146.2505
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Product Description
Catalog Number:
AG01C83Q
Chemical Name:
3-(methylsulfanyl)cyclohexan-1-ol, Mixture of diastereomers
CAS Number:
51755-67-0
Molecular Formula:
C7H14OS
Molecular Weight:
146.2505
MDL Number:
MFCD30333087
IUPAC Name:
3-methylsulfanylcyclohexan-1-ol
InChI:
InChI=1S/C7H14OS/c1-9-7-4-2-3-6(8)5-7/h6-8H,2-5H2,1H3
InChI Key:
DFLWDNWYHGCEPB-UHFFFAOYSA-N
SMILES:
CSC1CCCC(C1)O
Properties
Complexity:
85  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.077g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.248g/mol
Monoisotopic Mass:
146.077g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties