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945999-94-0 | 2-(4-Bromophenoxy)ethyl methanesulfonate
CAS No: 945999-94-0 Catalog No: AG01EZJU MDL No:
Product Description
Catalog Number:
AG01EZJU
Chemical Name:
2-(4-Bromophenoxy)ethyl methanesulfonate
CAS Number:
945999-94-0
Molecular Formula:
C9H11BrO4S
Molecular Weight:
295.1502
IUPAC Name:
2-(4-bromophenoxy)ethyl methanesulfonate
InChI:
InChI=1S/C9H11BrO4S/c1-15(11,12)14-7-6-13-9-4-2-8(10)3-5-9/h2-5H,6-7H2,1H3
InChI Key:
UCRPOQUVOIOSKM-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)OCCOS(=O)(=O)C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.956g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.147g/mol
Monoisotopic Mass:
293.956g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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