Home Halogens 1-(3-bromophenyl)-2-(methylamino)ethan-1-ol

1-(3-bromophenyl)-2-(methylamino)ethan-1-ol

CAS No.:
58777-85-8
Catalog Number:
AG01AL72
Molecular Formula:
C9H12BrNO
Molecular Weight:
230.1017
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Product Description
Catalog Number:
AG01AL72
Chemical Name:
1-(3-bromophenyl)-2-(methylamino)ethan-1-ol
CAS Number:
58777-85-8
Molecular Formula:
C9H12BrNO
Molecular Weight:
230.1017
MDL Number:
MFCD11938630
IUPAC Name:
1-(3-bromophenyl)-2-(methylamino)ethanol
InChI:
InChI=1S/C9H12BrNO/c1-11-6-9(12)7-3-2-4-8(10)5-7/h2-5,9,11-12H,6H2,1H3
InChI Key:
ZSHMDPGVNLYOSQ-UHFFFAOYSA-N
SMILES:
CNCC(c1cccc(c1)Br)O
Properties
Complexity:
132  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
230.105g/mol
Monoisotopic Mass:
229.01g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties