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1611-56-9 | 1-Undecanol, 11-bromo-
CAS No: 1611-56-9 Catalog No: AG001S5S MDL No:MFCD00004752
Product Description
Catalog Number:
AG001S5S
Chemical Name:
1-Undecanol, 11-bromo-
CAS Number:
1611-56-9
Molecular Formula:
C11H23BrO
Molecular Weight:
251.2037
MDL Number:
MFCD00004752
IUPAC Name:
11-bromoundecan-1-ol
InChI:
InChI=1S/C11H23BrO/c12-10-8-6-4-2-1-3-5-7-9-11-13/h13H,1-11H2
InChI Key:
XFGANBYCJWQYBI-UHFFFAOYSA-N
SMILES:
OCCCCCCCCCCCBr
EC Number:
216-554-3
NSC Number:
4029
Properties
Complexity:
86.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.093g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.208g/mol
Monoisotopic Mass:
250.093g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
Literature
| Title | Journal |
|---|---|
| Synthesis of 3-alkyl pyridinium alkaloids from the arctic sponge Haliclona viscosa. | Marine drugs 20100101 |
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