Ethyl 2-bromononan-1-oate

HCID 110997
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Basic information

CAS
7425-60-7
Standard SMILES
CCCCCCCC(Br)C(=O)OCC
InChIKey
QARKIRQNOLQDFJ-UHFFFAOYSA-N
Molecular formula
C11H21BrO2
Average molar mass
265.19 g/mol
Monoisotopic mass
264.07249

Names & identifiers

Preferred name
Ethyl 2-bromononan-1-oate
IUPAC
ethyl 2-bromononanoate
English name
ethyl 2-bromononan-1-oate
Molecular formula
C11H21BrO2
Molecular weight
265.18724

Names & synonyms

ethyl 2-bromononanoateEthyl 2-bromononan-1-oate7425-60-7Nonanoic acid, 2-bromoethyl esterEINECS 231-060-8ethyl 2-bromo-nonanoateSCHEMBL8321622DTXSID60995766alpha-bromo-nonanoic acid ethyl esterNS000472332-Bromononanoic acid ethyl ester

Database identifiers

CAS
7425-60-7
PubChem CID
110997
DTXSID
DTXSID60995766
EC Number
231-060-8
Nikkaji
J278.831D

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
9
Heavy atoms
14

Experimental & physicochemical properties

Kovats Retention Index1582

Related reactions

6 records
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Compound notes

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