Home Other Building Blocks 101499-71-2
101499-71-2,MFCD00666098
Catalog No.:AA0004JV
101499-71-2 | Ethyl 5-(3,4-dimethoxyphenyl)-5-oxovalerate
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95.0%
3 weeks  
$257.00   $180.00
- +
500mg
95.0%
3 weeks  
$428.00   $300.00
- +
1g
95.0%
3 weeks  
$585.00   $410.00
- +
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Technical Information
Catalog Number:
AA0004JV
Chemical Name:
Ethyl 5-(3,4-dimethoxyphenyl)-5-oxovalerate
CAS Number:
101499-71-2
Molecular Formula:
C15H20O5
Molecular Weight:
280.3163
MDL Number:
MFCD00666098
IUPAC Name:
ethyl 5-(3,4-dimethoxyphenyl)-5-oxopentanoate
InChI:
InChI=1S/C15H20O5/c1-4-20-15(17)7-5-6-12(16)11-8-9-13(18-2)14(10-11)19-3/h8-10H,4-7H2,1-3H3
InChI Key:
JGSWJILZJRDXFJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCC(=O)c1ccc(c(c1)OC)OC
NSC Number:
105644
Properties
Computed Properties
 
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.131g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.32g/mol
Monoisotopic Mass:
280.131g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

Synonyms
 
101499-71-2 
ETHYL 5-(3,4-DIMETHOXYPHENYL)-5-OXOVALERATE 
MFCD00666098 
AKOS016023418 
MCULE-5727944620 
NSC-105644 
Z1697934539 
Benzenepentanoic acid, 3,4-dimethoxy-delta-oxo-, ethyl ester 
5-(3,4-DIMETHOXY-PHENYL)-5-OXO-PENTANOIC ACID ETHYL ESTER 
AR-1I9333 
CID266841 
10157-76-3 
ethyl 5-(3,4-dimethoxyphenyl)-5-oxopentanoate 
NSC105644 
AC1L6GXI 
AC1Q656F 
CTK3J9842 
DTXSID50295823 
ZINC1686640 
7669c 
Literature
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