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23386-17-6 | Benzene, 1-bromo-4-(2-chloroethyl)-
CAS No: 23386-17-6 Catalog No: AG002N2I MDL No:MFCD11110150
Product Description
Catalog Number:
AG002N2I
Chemical Name:
Benzene, 1-bromo-4-(2-chloroethyl)-
CAS Number:
23386-17-6
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
MDL Number:
MFCD11110150
IUPAC Name:
1-bromo-4-(2-chloroethyl)benzene
InChI:
InChI=1S/C8H8BrCl/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5-6H2
InChI Key:
ZVPRASGPISZNTC-UHFFFAOYSA-N
SMILES:
ClCCc1ccc(cc1)Br
Properties
Complexity:
87.3
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:
3.5
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