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1332350-80-7 | 1-Bromo-2-n-propylsulfanylbenzene
CAS No: 1332350-80-7 Catalog No: AG01ES7Y MDL No:
Product Description
Catalog Number:
AG01ES7Y
Chemical Name:
1-Bromo-2-n-propylsulfanylbenzene
CAS Number:
1332350-80-7
Molecular Formula:
C9H11BrS
Molecular Weight:
231.1526
IUPAC Name:
1-bromo-2-propylsulfanylbenzene
InChI:
InChI=1S/C9H11BrS/c1-2-7-11-9-6-4-3-5-8(9)10/h3-6H,2,7H2,1H3
InChI Key:
CCYFUGBAHQQLQN-UHFFFAOYSA-N
SMILES:
CCCSc1ccccc1Br
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.976g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.151g/mol
Monoisotopic Mass:
229.976g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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