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14088-81-4 | 1,2-Ethanediamine, N1-(3-bromophenyl)-
CAS No: 14088-81-4 Catalog No: AG001CY7 MDL No:MFCD11594013
Product Description
Catalog Number:
AG001CY7
Chemical Name:
1,2-Ethanediamine, N1-(3-bromophenyl)-
CAS Number:
14088-81-4
Molecular Formula:
C8H11BrN2
Molecular Weight:
215.0903
MDL Number:
MFCD11594013
IUPAC Name:
N'-(3-bromophenyl)ethane-1,2-diamine
InChI:
InChI=1S/C8H11BrN2/c9-7-2-1-3-8(6-7)11-5-4-10/h1-3,6,11H,4-5,10H2
InChI Key:
XWASBZNKFJVMAU-UHFFFAOYSA-N
SMILES:
NCCNc1cccc(c1)Br
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.011g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.094g/mol
Monoisotopic Mass:
214.011g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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