Home Other Building Blocks (3-methylcyclohexyl)methanol

(3-methylcyclohexyl)methanol

CAS No.:
53018-27-2
Catalog Number:
AG01A4PB
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
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Product Description
Catalog Number:
AG01A4PB
Chemical Name:
(3-methylcyclohexyl)methanol
CAS Number:
53018-27-2
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD11204067
IUPAC Name:
(3-methylcyclohexyl)methanol
InChI:
InChI=1S/C8H16O/c1-7-3-2-4-8(5-7)6-9/h7-9H,2-6H2,1H3
InChI Key:
KGSNUSZZYWSOFK-UHFFFAOYSA-N
SMILES:
OCC1CCCC(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:
1  
Isotope Atom Count:
0
Molecular Weight:
128.215g/mol
Monoisotopic Mass:
128.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties