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16793-91-2 | Benzene, 1-(2-bromoethyl)-2-chloro-
CAS No: 16793-91-2 Catalog No: AG001XOX MDL No:MFCD04117464
Product Description
Catalog Number:
AG001XOX
Chemical Name:
Benzene, 1-(2-bromoethyl)-2-chloro-
CAS Number:
16793-91-2
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
MDL Number:
MFCD04117464
IUPAC Name:
1-(2-bromoethyl)-2-chlorobenzene
InChI:
InChI=1S/C8H8BrCl/c9-6-5-7-3-1-2-4-8(7)10/h1-4H,5-6H2
InChI Key:
AECBVDLERUETKG-UHFFFAOYSA-N
SMILES:
BrCCc1ccccc1Cl
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:
3.6
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