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Home Carboxys 4-Ethoxyphenyl trans-4-butylcyclohexanecarboxylate

4-Ethoxyphenyl trans-4-butylcyclohexanecarboxylate

CAS No.:
67589-47-3
Catalog Number:
AG005M6T
Molecular Formula:
C19H28O3
Molecular Weight:
304.4238
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$75
- +
10g
98%
In Stock USA
United States
$125
- +
25g
98%
In Stock USA
United States
$225
- +
100g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG005M6T
Chemical Name:
4-Ethoxyphenyl trans-4-butylcyclohexanecarboxylate
CAS Number:
67589-47-3
Molecular Formula:
C19H28O3
Molecular Weight:
304.4238
MDL Number:
MFCD01941073
IUPAC Name:
(4-ethoxyphenyl) 4-butylcyclohexane-1-carboxylate
InChI:
InChI=1S/C19H28O3/c1-3-5-6-15-7-9-16(10-8-15)19(20)22-18-13-11-17(12-14-18)21-4-2/h11-16H,3-10H2,1-2H3
InChI Key:
JAYBMJPZPJBTQZ-UHFFFAOYSA-N
SMILES:
CCCC[C@@H]1CC[C@H](CC1)C(=O)Oc1ccc(cc1)OCC
EC Number:
266-745-0
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.204g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.43g/mol
Monoisotopic Mass:
304.204g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties