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Home > Bromides > 1160574-42-4
1160574-42-4 | 4-Bromo-2,3-dichlorobenzonitrile
CAS No: 1160574-42-4 Catalog No: AG01FEK0 MDL No:MFCD11845899
Product Description
Catalog Number:
AG01FEK0
Chemical Name:
4-Bromo-2,3-dichlorobenzonitrile
CAS Number:
1160574-42-4
Molecular Formula:
C7H2BrCl2N
Molecular Weight:
250.9075
MDL Number:
MFCD11845899
IUPAC Name:
4-bromo-2,3-dichlorobenzonitrile
InChI:
InChI=1S/C7H2BrCl2N/c8-5-2-1-4(3-11)6(9)7(5)10/h1-2H
InChI Key:
DWXVYJNPNBJMCR-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1Cl)Cl)Br
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.875g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.904g/mol
Monoisotopic Mass:
248.875g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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