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14273-90-6 | Methyl 6-bromohexanoate
CAS No: 14273-90-6 Catalog No: AG003589 MDL No:MFCD00187528
Product Description
Catalog Number:
AG003589
Chemical Name:
Methyl 6-bromohexanoate
CAS Number:
14273-90-6
Molecular Formula:
C7H13BrO2
Molecular Weight:
209.0809
MDL Number:
MFCD00187528
IUPAC Name:
methyl 6-bromohexanoate
InChI:
InChI=1S/C7H13BrO2/c1-10-7(9)5-3-2-4-6-8/h2-6H2,1H3
InChI Key:
KYLVAMSNNZMHSX-UHFFFAOYSA-N
SMILES:
BrCCCCCC(=O)OC
EC Number:
604-307-6
Properties
Complexity:
93.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.01g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.083g/mol
Monoisotopic Mass:
208.01g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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