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Home Other Building Blocks Benzyl tetradecanoate

Benzyl tetradecanoate

CAS No.:
31161-71-4
Catalog Number:
AG00361I
Molecular Formula:
C21H34O2
Molecular Weight:
318.4935
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$392
- +
5g
95%
In Stock USA
United States
$1173
- +
Product Description
Catalog Number:
AG00361I
Chemical Name:
Benzyl tetradecanoate
CAS Number:
31161-71-4
Molecular Formula:
C21H34O2
Molecular Weight:
318.4935
MDL Number:
MFCD00480853
IUPAC Name:
benzyl tetradecanoate
InChI:
InChI=1S/C21H34O2/c1-2-3-4-5-6-7-8-9-10-11-15-18-21(22)23-19-20-16-13-12-14-17-20/h12-14,16-17H,2-11,15,18-19H2,1H3
InChI Key:
TUMGCEIAYMZKEM-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC(=O)OCc1ccccc1
EC Number:
250-493-3
UNII:
93YQ04RQ2N
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.256g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.501g/mol
Monoisotopic Mass:
318.256g/mol
Rotatable Bond Count:
15  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.9  
Literature
Title Journal
Design, synthesis, antibacterial, and QSAR studies of myristic acid derivatives. Bioorganic & medicinal chemistry letters 20060601
Properties