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14804-61-6 | Benzene, 1-(1-bromoethyl)-4-chloro-
CAS No: 14804-61-6 Catalog No: AG001FE6 MDL No:MFCD11180323
Product Description
Catalog Number:
AG001FE6
Chemical Name:
Benzene, 1-(1-bromoethyl)-4-chloro-
CAS Number:
14804-61-6
Molecular Formula:
C8H8BrCl
Molecular Weight:
219.5061
MDL Number:
MFCD11180323
IUPAC Name:
1-(1-bromoethyl)-4-chlorobenzene
InChI:
InChI=1S/C8H8BrCl/c1-6(9)7-2-4-8(10)5-3-7/h2-6H,1H3
InChI Key:
JYQIUMNHRQYUHC-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)Cl)Br
EC Number:
238-870-0
Properties
Complexity:
97.4
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:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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