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1,2-Epoxyoctane

CAS No.:
2984-50-1
Catalog Number:
AG0032KX
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
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Product Description
Catalog Number:
AG0032KX
Chemical Name:
1,2-Epoxyoctane
CAS Number:
2984-50-1
Molecular Formula:
C8H16O
Molecular Weight:
128.2120
MDL Number:
MFCD00005157
IUPAC Name:
2-hexyloxirane
InChI:
InChI=1S/C8H16O/c1-2-3-4-5-6-8-7-9-8/h8H,2-7H2,1H3
InChI Key:
NJWSNNWLBMSXQR-UHFFFAOYSA-N
SMILES:
CCCCCCC1OC1
EC Number:
221-047-5
NSC Number:
24246
Properties
Complexity:
71  
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:
5  
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
Cloning and characterization of an epoxide hydrolase from Cupriavidus metallidurans-CH34. Protein expression and purification 20110901
Searching for monooxygenases and hydrolases in bacteria from an extreme environment. Applied microbiology and biotechnology 20100601
Alkylation of 2-substituted (6-methyl-2-pyridyl)methyllithium species with epoxides. The Journal of organic chemistry 20090206
Isolation and functional analysis of cytochrome P450 CYP153A genes from various environments. Bioscience, biotechnology, and biochemistry 20051201
Improved catalytic activity of homochiral dimeric cobalt-salen complex in hydrolytic kinetic resolution of terminal racemic epoxides. Chirality 20051101
Calcium alginate entrapment of the yeast Rhodosporidium toruloides for the kinetic resolution of 1,2-epoxyoctane. Biotechnology letters 20031001
Properties