sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 2,6-Diethylphenol

2,6-Diethylphenol

CAS No.:
1006-59-3
Catalog Number:
AG0002FV
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
95%
In Stock USA
United States
$216
- +
10g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG0002FV
Chemical Name:
2,6-Diethylphenol
CAS Number:
1006-59-3
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
MDL Number:
MFCD01707589
IUPAC Name:
2,6-diethylphenol
InChI:
InChI=1S/C10H14O/c1-3-8-6-5-7-9(4-2)10(8)11/h5-7,11H,3-4H2,1-2H3
InChI Key:
METWAQRCMRWDAW-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1O)CC
EC Number:
213-744-8
UNII:
FXC69FTD6U
Properties
Complexity:
99.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.104g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
150.221g/mol
Monoisotopic Mass:
150.104g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
Recognition of anesthetic barbiturates by a protein binding site: a high resolution structural analysis. PloS one 20120101
A unitary anesthetic binding site at high resolution. The Journal of biological chemistry 20090904
4D-QSAR analysis of a set of propofol analogues: mapping binding sites for an anesthetic phenol on the GABA(A) receptor. Journal of medicinal chemistry 20020718
Properties