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850349-18-7 | Ethyl 2-((2-bromopyridin-3-yl);oxy);acetate
CAS No: 850349-18-7 Catalog No: AG004PXT MDL No:MFCD08706080
Product Description
Catalog Number:
AG004PXT
Chemical Name:
Ethyl 2-((2-bromopyridin-3-yl);oxy);acetate
CAS Number:
850349-18-7
Molecular Formula:
C9H10BrNO3
Molecular Weight:
260.0846
MDL Number:
MFCD08706080
IUPAC Name:
ethyl 2-(2-bromopyridin-3-yl)oxyacetate
InChI:
InChI=1S/C9H10BrNO3/c1-2-13-8(12)6-14-7-4-3-5-11-9(7)10/h3-5H,2,6H2,1H3
InChI Key:
NRLUWIISBQIZAA-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1cccnc1Br
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.984g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.087g/mol
Monoisotopic Mass:
258.984g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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