Home Halogens ethyl 4-bromopentanoate

ethyl 4-bromopentanoate

CAS No.:
27126-42-7
Catalog Number:
AG01A8CO
Molecular Formula:
C7H13BrO2
Molecular Weight:
209.0809
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Product Description
Catalog Number:
AG01A8CO
Chemical Name:
ethyl 4-bromopentanoate
CAS Number:
27126-42-7
Molecular Formula:
C7H13BrO2
Molecular Weight:
209.0809
MDL Number:
MFCD16693250
IUPAC Name:
ethyl 4-bromopentanoate
InChI:
InChI=1S/C7H13BrO2/c1-3-10-7(9)5-4-6(2)8/h6H,3-5H2,1-2H3
InChI Key:
CTVCPHLFHPQRNF-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCC(Br)C
NSC Number:
245490
Properties
Complexity:
104  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.01g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.083g/mol
Monoisotopic Mass:
208.01g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties