Home Halogens methyl 2,3-dibromobutanoate

methyl 2,3-dibromobutanoate

CAS No.:
5469-24-9
Catalog Number:
AG00E14F
Molecular Formula:
C5H8Br2O2
Molecular Weight:
259.9238
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Product Description
Catalog Number:
AG00E14F
Chemical Name:
methyl 2,3-dibromobutanoate
CAS Number:
5469-24-9
Molecular Formula:
C5H8Br2O2
Molecular Weight:
259.9238
MDL Number:
MFCD07366333
IUPAC Name:
methyl 2,3-dibromobutanoate
InChI:
InChI=1S/C5H8Br2O2/c1-3(6)4(7)5(8)9-2/h3-4H,1-2H3
InChI Key:
HABGKCAIPKECQJ-UHFFFAOYSA-N
SMILES:
COC(=O)C(C(Br)C)Br
NSC Number:
25304
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.887g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.925g/mol
Monoisotopic Mass:
257.889g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties