Home Halogens 1-[(2-bromoethyl)sulfanyl]-3-methoxybenzene

1-[(2-bromoethyl)sulfanyl]-3-methoxybenzene

CAS No.:
5132-26-3
Catalog Number:
AG01B50D
Molecular Formula:
C9H11BrOS
Molecular Weight:
247.1520
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Product Description
Catalog Number:
AG01B50D
Chemical Name:
1-[(2-bromoethyl)sulfanyl]-3-methoxybenzene
CAS Number:
5132-26-3
Molecular Formula:
C9H11BrOS
Molecular Weight:
247.1520
MDL Number:
MFCD09813583
IUPAC Name:
1-(2-bromoethylsulfanyl)-3-methoxybenzene
InChI:
InChI=1S/C9H11BrOS/c1-11-8-3-2-4-9(7-8)12-6-5-10/h2-4,7H,5-6H2,1H3
InChI Key:
MPNMEEMRWQLZJD-UHFFFAOYSA-N
SMILES:
BrCCSc1cccc(c1)OC
Properties
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.971g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.15g/mol
Monoisotopic Mass:
245.971g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties