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Home > Bromides > 1314776-50-5
1314776-50-5 | Cyclopropanecarbonitrile, 1-(4-bromo-3-chlorophenyl)-
CAS No: 1314776-50-5 Catalog No: AG000W8Y MDL No:MFCD19692731
Product Description
Catalog Number:
AG000W8Y
Chemical Name:
Cyclopropanecarbonitrile, 1-(4-bromo-3-chlorophenyl)-
CAS Number:
1314776-50-5
Molecular Formula:
C10H7BrClN
Molecular Weight:
256.5263
MDL Number:
MFCD19692731
IUPAC Name:
1-(4-bromo-3-chlorophenyl)cyclopropane-1-carbonitrile
InChI:
InChI=1S/C10H7BrClN/c11-8-2-1-7(5-9(8)12)10(6-13)3-4-10/h1-2,5H,3-4H2
InChI Key:
BGXVQYBQBYXGKL-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)c1ccc(c(c1)Cl)Br
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.945g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.527g/mol
Monoisotopic Mass:
254.945g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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