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1214342-53-6 | Benzenemethanamine, 4-bromo-3-fluoro-, hydrochloride (1:1)
CAS No: 1214342-53-6 Catalog No: AG0014UQ MDL No:MFCD12546113
Product Description
Catalog Number:
AG0014UQ
Chemical Name:
Benzenemethanamine, 4-bromo-3-fluoro-, hydrochloride (1:1)
CAS Number:
1214342-53-6
Molecular Formula:
C7H8BrClFN
Molecular Weight:
240.5005
MDL Number:
MFCD12546113
IUPAC Name:
(4-bromo-3-fluorophenyl)methanamine;hydrochloride
InChI:
InChI=1S/C7H7BrFN.ClH/c8-6-2-1-5(4-10)3-7(6)9;/h1-3H,4,10H2;1H
InChI Key:
YURPLAWBHIYAOX-UHFFFAOYSA-N
SMILES:
NCc1ccc(c(c1)F)Br.Cl
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.951g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.5g/mol
Monoisotopic Mass:
238.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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