Home Halogens (1S)-1-(2-bromo-4-methoxyphenyl)ethan-1-ol

(1S)-1-(2-bromo-4-methoxyphenyl)ethan-1-ol

CAS No.:
1432670-74-0
Catalog Number:
AG01A4SV
Molecular Formula:
C9H11BrO2
Molecular Weight:
231.0864
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Product Description
Catalog Number:
AG01A4SV
Chemical Name:
(1S)-1-(2-bromo-4-methoxyphenyl)ethan-1-ol
CAS Number:
1432670-74-0
Molecular Formula:
C9H11BrO2
Molecular Weight:
231.0864
MDL Number:
MFCD24302925
IUPAC Name:
1-(2-bromo-4-methoxyphenyl)ethanol
InChI:
InChI=1S/C9H11BrO2/c1-6(11)8-4-3-7(12-2)5-9(8)10/h3-6,11H,1-2H3
InChI Key:
UJSSRKRHXCIJRN-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)Br)[C@@H](O)C
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.994g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.089g/mol
Monoisotopic Mass:
229.994g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties