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885267-05-0 | Benzene,1-bromo-2-(cyclobutylthio)-
CAS No: 885267-05-0 Catalog No: AG00474Y MDL No:
Product Description
Catalog Number:
AG00474Y
Chemical Name:
Benzene,1-bromo-2-(cyclobutylthio)-
CAS Number:
885267-05-0
Molecular Formula:
C10H11BrS
Molecular Weight:
243.1633
IUPAC Name:
1-bromo-2-cyclobutylsulfanylbenzene
InChI:
InChI=1S/C10H11BrS/c11-9-6-1-2-7-10(9)12-8-4-3-5-8/h1-2,6-8H,3-5H2
InChI Key:
TUWKNYHPIDWUGA-UHFFFAOYSA-N
SMILES:
Brc1ccccc1SC1CCC1
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.976g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.162g/mol
Monoisotopic Mass:
241.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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