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123158-68-9 | Benzenamine, 3-bromo-5-ethyl-
CAS No: 123158-68-9 Catalog No: AG000K2Y MDL No:MFCD16659612
Product Description
Catalog Number:
AG000K2Y
Chemical Name:
Benzenamine, 3-bromo-5-ethyl-
CAS Number:
123158-68-9
Molecular Formula:
C8H10BrN
Molecular Weight:
200.0757
MDL Number:
MFCD16659612
IUPAC Name:
3-bromo-5-ethylaniline
InChI:
InChI=1S/C8H10BrN/c1-2-6-3-7(9)5-8(10)4-6/h3-5H,2,10H2,1H3
InChI Key:
YPAQYCIEIXDIQG-UHFFFAOYSA-N
SMILES:
CCc1cc(N)cc(c1)Br
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.079g/mol
Monoisotopic Mass:
199g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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