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951886-41-2 | 2-Bromo-3-(5-Ethoxycarbonyl-2-furanyl)-1-propene
CAS No: 951886-41-2 Catalog No: AG01EZOT MDL No:
Product Description
Catalog Number:
AG01EZOT
Chemical Name:
2-Bromo-3-(5-Ethoxycarbonyl-2-furanyl)-1-propene
CAS Number:
951886-41-2
Molecular Formula:
C10H11BrO3
Molecular Weight:
259.0965
IUPAC Name:
ethyl 5-(2-bromoprop-2-enyl)furan-2-carboxylate
InChI:
InChI=1S/C10H11BrO3/c1-3-13-10(12)9-5-4-8(14-9)6-7(2)11/h4-5H,2-3,6H2,1H3
InChI Key:
RXPZYRNYSLMGEA-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(o1)CC(=C)Br
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.989g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.099g/mol
Monoisotopic Mass:
257.989g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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