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122327-99-5 | Benzenamine, N-ethyl-2-methoxy-, hydrobromide (1:1)
CAS No: 122327-99-5 Catalog No: AG00173N MDL No:
Product Description
Catalog Number:
AG00173N
Chemical Name:
Benzenamine, N-ethyl-2-methoxy-, hydrobromide (1:1)
CAS Number:
122327-99-5
Molecular Formula:
C9H14BrNO
Molecular Weight:
232.1176
IUPAC Name:
N-ethyl-2-methoxyaniline;hydrobromide
InChI:
InChI=1S/C9H13NO.BrH/c1-3-10-8-6-4-5-7-9(8)11-2;/h4-7,10H,3H2,1-2H3;1H
InChI Key:
NTXVZRILVWZRRU-UHFFFAOYSA-N
SMILES:
CCNc1ccccc1OC.Br
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.026g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.121g/mol
Monoisotopic Mass:
231.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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