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154607-01-9 | 4-Bromo-2-chlorobenzonitrile
CAS No: 154607-01-9 Catalog No: AG0037PU MDL No:MFCD00040883
Product Description
Catalog Number:
AG0037PU
Chemical Name:
4-Bromo-2-chlorobenzonitrile
CAS Number:
154607-01-9
Molecular Formula:
C7H3BrClN
Molecular Weight:
216.4624
MDL Number:
MFCD00040883
IUPAC Name:
4-bromo-2-chlorobenzonitrile
InChI:
InChI=1S/C7H3BrClN/c8-6-2-1-5(4-10)7(9)3-6/h1-3H
InChI Key:
AYQBMZNSJPVADT-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1Cl)Br
EC Number:
679-039-6
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.914g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.462g/mol
Monoisotopic Mass:
214.914g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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