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2623-95-2 | Decanoic acid, 2-bromo-
CAS No: 2623-95-2 Catalog No: AG002SEB MDL No:MFCD00014335
Product Description
Catalog Number:
AG002SEB
Chemical Name:
Decanoic acid, 2-bromo-
CAS Number:
2623-95-2
Molecular Formula:
C10H19BrO2
Molecular Weight:
251.1607
MDL Number:
MFCD00014335
IUPAC Name:
2-bromodecanoic acid
InChI:
InChI=1S/C10H19BrO2/c1-2-3-4-5-6-7-8-9(11)10(12)13/h9H,2-8H2,1H3,(H,12,13)
InChI Key:
KNLOTZNPRIFUAR-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(C(=O)O)Br
EC Number:
220-086-5
NSC Number:
99841
Properties
Complexity:
137
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:
1
Isotope Atom Count:
0
Molecular Weight:
251.164g/mol
Monoisotopic Mass:
250.057g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Literature
| Title | Journal |
|---|---|
| Solvent extraction and lanthanide complexation studies with new terdentate ligands containing two 1,3,5-triazine moieties. | Dalton transactions (Cambridge, England : 2003) 20040121 |
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