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144027-81-6

144027-81-6 | Benzene, 1-(bromomethyl)-3-(chloromethyl)-

CAS No: 144027-81-6 Catalog No: AG001ITW MDL No:

Product Description

Catalog Number:
AG001ITW
Chemical Name:
Benzene, 1-(bromomethyl)-3-(chloromethyl)-
CAS Number:
144027-81-6
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
IUPAC Name:
1-(bromomethyl)-3-(chloromethyl)benzene
InChI:
InChI=1S/C8H8BrCl/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5-6H2
InChI Key:
CFYZRGMUYARCHJ-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1)CBr

Properties

Complexity:
95.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.95g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.506g/mol
Monoisotopic Mass:
217.95g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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