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13137-43-4 | Hexanoic acid, 2,6-dibromo-
CAS No: 13137-43-4 Catalog No: AG000W0W MDL No:MFCD00046517
Product Description
Catalog Number:
AG000W0W
Chemical Name:
Hexanoic acid, 2,6-dibromo-
CAS Number:
13137-43-4
Molecular Formula:
C6H10Br2O2
Molecular Weight:
273.9504
MDL Number:
MFCD00046517
IUPAC Name:
2,6-dibromohexanoic acid
InChI:
InChI=1S/C6H10Br2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4H2,(H,9,10)
InChI Key:
DQULMCCESHRDMR-UHFFFAOYSA-N
SMILES:
BrCCCCC(C(=O)O)Br
NSC Number:
510654
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.903g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.952g/mol
Monoisotopic Mass:
271.905g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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