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69190-56-3 | Benzene, 2-bromo-1-chloro-3-methyl-
CAS No: 69190-56-3 Catalog No: AG00IBWS MDL No:MFCD00060645
Product Description
Catalog Number:
AG00IBWS
Chemical Name:
Benzene, 2-bromo-1-chloro-3-methyl-
CAS Number:
69190-56-3
Molecular Formula:
C7H6BrCl
Molecular Weight:
205.4795
MDL Number:
MFCD00060645
IUPAC Name:
2-bromo-1-chloro-3-methylbenzene
InChI:
InChI=1S/C7H6BrCl/c1-5-3-2-4-6(9)7(5)8/h2-4H,1H3
InChI Key:
ADSIBTDRKLGGEO-UHFFFAOYSA-N
SMILES:
Brc1c(C)cccc1Cl
Properties
Complexity:
94.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.934g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.479g/mol
Monoisotopic Mass:
203.934g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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