Home Other Building Blocks 1-methoxy-3-methylcyclohexane

1-methoxy-3-methylcyclohexane

CAS No.:
52204-64-5
Catalog Number:
AG019P5N
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
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Product Description
Catalog Number:
AG019P5N
Chemical Name:
1-methoxy-3-methylcyclohexane
CAS Number:
52204-64-5
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD13271431
IUPAC Name:
1-methoxy-3-methylcyclohexane
InChI:
InChI=1S/C8H16O/c1-7-4-3-5-8(6-7)9-2/h7-8H,3-6H2,1-2H3
InChI Key:
YCPDYLJKHHAUBS-UHFFFAOYSA-N
SMILES:
COC1CCCC(C1)C
Properties
Complexity:
80.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.12g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties