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202865-68-7 | Benzenemethanamine, 3-bromo-4-fluoro-, hydrochloride (1:1)
CAS No: 202865-68-7 Catalog No: AG0028HE MDL No:MFCD00143094
Product Description
Catalog Number:
AG0028HE
Chemical Name:
Benzenemethanamine, 3-bromo-4-fluoro-, hydrochloride (1:1)
CAS Number:
202865-68-7
Molecular Formula:
C7H8BrClFN
Molecular Weight:
240.5005
MDL Number:
MFCD00143094
IUPAC Name:
(3-bromo-4-fluorophenyl)methanamine;hydrochloride
InChI:
InChI=1S/C7H7BrFN.ClH/c8-6-3-5(4-10)1-2-7(6)9;/h1-3H,4,10H2;1H
InChI Key:
RSFNYNQGERWCMT-UHFFFAOYSA-N
SMILES:
NCc1ccc(c(c1)Br)F.Cl
EC Number:
606-495-5
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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