Home Halogens 4-bromo-3-isopropoxyaniline

4-bromo-3-isopropoxyaniline

CAS No.:
1336903-50-4
Catalog Number:
AG01C09P
Molecular Formula:
C9H12BrNO
Molecular Weight:
230.1017
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Product Description
Catalog Number:
AG01C09P
Chemical Name:
4-bromo-3-isopropoxyaniline
CAS Number:
1336903-50-4
Molecular Formula:
C9H12BrNO
Molecular Weight:
230.1017
MDL Number:
MFCD27943834
IUPAC Name:
4-bromo-3-propan-2-yloxyaniline
InChI:
InChI=1S/C9H12BrNO/c1-6(2)12-9-5-7(11)3-4-8(9)10/h3-6H,11H2,1-2H3
InChI Key:
ODESMYFMQFQGGI-UHFFFAOYSA-N
SMILES:
CC(Oc1cc(N)ccc1Br)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:
229.01g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.105g/mol
Monoisotopic Mass:
229.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties