Home Bromides 29823-21-0
29823-21-0,MFCD00045057
Catalog No.:AA003645
29823-21-0 | Ethyl 8-bromooctanoate
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$15.00   $10.00
- +
5g
95%
in stock  
$19.00   $13.00
- +
10g
95%
in stock  
$35.00   $24.00
- +
25g
95%
in stock  
$76.00   $53.00
- +
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Technical Information
Catalog Number:
AA003645
Chemical Name:
Ethyl 8-bromooctanoate
CAS Number:
29823-21-0
Molecular Formula:
C10H19BrO2
Molecular Weight:
251.1607
MDL Number:
MFCD00045057
IUPAC Name:
ethyl 8-bromooctanoate
InChI:
InChI=1S/C10H19BrO2/c1-2-13-10(12)8-6-4-3-5-7-9-11/h2-9H2,1H3
InChI Key:
UBTQVPMVWAEGAC-UHFFFAOYSA-N
SMILES:
BrCCCCCCCC(=O)OCC
EC Number:
608-417-5
NSC Number:
100182
Properties
Computed Properties
 
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.057g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.164g/mol
Monoisotopic Mass:
250.057g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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