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Home Other Building Blocks Cyclohexane, butyl-

Cyclohexane, butyl-

CAS No.:
1678-93-9
Catalog Number:
AG001XMB
Molecular Formula:
C10H20
Molecular Weight:
140.2658
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Product Description
Catalog Number:
AG001XMB
Chemical Name:
Cyclohexane, butyl-
CAS Number:
1678-93-9
Molecular Formula:
C10H20
Molecular Weight:
140.2658
MDL Number:
MFCD00001530
IUPAC Name:
butylcyclohexane
InChI:
InChI=1S/C10H20/c1-2-3-7-10-8-5-4-6-9-10/h10H,2-9H2,1H3
InChI Key:
GGBJHURWWWLEQH-UHFFFAOYSA-N
SMILES:
CCCCC1CCCCC1
EC Number:
216-837-1
NSC Number:
8469
Properties
Complexity:
70.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.157g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.27g/mol
Monoisotopic Mass:
140.157g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Literature
Title Journal
Thermodynamic study of alkyl-cyclohexanes in liquid, glassy, and crystalline states. The Journal of chemical physics 20060807
Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors. Journal of medicinal chemistry 20050602
Indigo production by Escherichia coli carrying the phenol hydroxylase gene from Acinetobacter sp strain ST-550 in a water-organic solvent two-phase system. Applied microbiology and biotechnology 20030201
Imino sugars that are less toxic but more potent as antivirals, in vitro, compared with N-n-nonyl DNJ. Antiviral chemistry & chemotherapy 20020901
Properties