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114325-55-2 | Furan, 2-[[(2-bromophenyl)sulfinyl]methyl]-
CAS No: 114325-55-2 Catalog No: AG000B3S MDL No:
Product Description
Catalog Number:
AG000B3S
Chemical Name:
Furan, 2-[[(2-bromophenyl)sulfinyl]methyl]-
CAS Number:
114325-55-2
Molecular Formula:
C11H9BrO2S
Molecular Weight:
285.1570
IUPAC Name:
2-[(2-bromophenyl)sulfinylmethyl]furan
InChI:
InChI=1S/C11H9BrO2S/c12-10-5-1-2-6-11(10)15(13)8-9-4-3-7-14-9/h1-7H,8H2
InChI Key:
HZLHOSDAEWLXKE-UHFFFAOYSA-N
SMILES:
Brc1ccccc1S(=O)Cc1ccco1
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.951g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.155g/mol
Monoisotopic Mass:
283.951g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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