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14980-92-8 | Tetradecanoic acid, 2-bromo-, ethyl ester
CAS No: 14980-92-8 Catalog No: AG001M1J MDL No:MFCD00026594
Product Description
Catalog Number:
AG001M1J
Chemical Name:
Tetradecanoic acid, 2-bromo-, ethyl ester
CAS Number:
14980-92-8
Molecular Formula:
C16H31BrO2
Molecular Weight:
335.3201
MDL Number:
MFCD00026594
IUPAC Name:
ethyl 2-bromotetradecanoate
InChI:
InChI=1S/C16H31BrO2/c1-3-5-6-7-8-9-10-11-12-13-14-15(17)16(18)19-4-2/h15H,3-14H2,1-2H3
InChI Key:
JQQZIRFEGUUJBP-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCC(C(=O)OCC)Br
EC Number:
239-059-4
NSC Number:
74506
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.151g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.326g/mol
Monoisotopic Mass:
334.151g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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