Home Halogens Benzene, [[(3-bromopropyl)thio]methyl]-

Benzene, [[(3-bromopropyl)thio]methyl]-

CAS No.:
88738-51-6
Catalog Number:
AG004E20
Molecular Formula:
C10H13BrS
Molecular Weight:
245.1792
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Product Description
Catalog Number:
AG004E20
Chemical Name:
Benzene, [[(3-bromopropyl)thio]methyl]-
CAS Number:
88738-51-6
Molecular Formula:
C10H13BrS
Molecular Weight:
245.1792
MDL Number:
MFCD12172069
IUPAC Name:
3-bromopropylsulfanylmethylbenzene
InChI:
InChI=1S/C10H13BrS/c11-7-4-8-12-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2
InChI Key:
ALSWGXGRTQDHEB-UHFFFAOYSA-N
SMILES:
BrCCCSCc1ccccc1
Properties
Complexity:
100  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.992g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.178g/mol
Monoisotopic Mass:
243.992g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties