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951886-26-3 | 2-Bromo-3-(5-(1,3-Dioxolan-2-yl)-2-thienyl)-1-propene
CAS No: 951886-26-3 Catalog No: AG01EZOK MDL No:
Product Description
Catalog Number:
AG01EZOK
Chemical Name:
2-Bromo-3-(5-(1,3-Dioxolan-2-yl)-2-thienyl)-1-propene
CAS Number:
951886-26-3
Molecular Formula:
C10H11BrO2S
Molecular Weight:
275.1621
IUPAC Name:
2-[5-(2-bromoprop-2-enyl)thiophen-2-yl]-1,3-dioxolane
InChI:
InChI=1S/C10H11BrO2S/c1-7(11)6-8-2-3-9(14-8)10-12-4-5-13-10/h2-3,10H,1,4-6H2
InChI Key:
NXVGUUWFEGWGRU-UHFFFAOYSA-N
SMILES:
BrC(=C)Cc1ccc(s1)C1OCCO1
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.966g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.16g/mol
Monoisotopic Mass:
273.966g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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