Home Halogens 3-(4-bromo-3-methylphenyl)-3-chloroprop-2-enenitrile

3-(4-bromo-3-methylphenyl)-3-chloroprop-2-enenitrile

CAS No.:
1567634-47-2
Catalog Number:
AG01B2KI
Molecular Formula:
C10H7BrClN
Molecular Weight:
256.5263
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Product Description
Catalog Number:
AG01B2KI
Chemical Name:
3-(4-bromo-3-methylphenyl)-3-chloroprop-2-enenitrile
CAS Number:
1567634-47-2
Molecular Formula:
C10H7BrClN
Molecular Weight:
256.5263
MDL Number:
MFCD26856298
IUPAC Name:
3-(4-bromo-3-methylphenyl)-3-chloroprop-2-enenitrile
InChI:
InChI=1S/C10H7BrClN/c1-7-6-8(2-3-9(7)11)10(12)4-5-13/h2-4,6H,1H3
InChI Key:
FQWGKTQVUSIPDC-UHFFFAOYSA-N
SMILES:
N#CC=C(c1ccc(c(c1)C)Br)Cl
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:
1  
XLogP3:
3.5  
Properties