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Home > Bromides > 1208075-19-7
1208075-19-7 | 3-Bromo-5-ethyltoluene
CAS No: 1208075-19-7 Catalog No: AG01FFK0 MDL No:MFCD12547777
Product Description
Catalog Number:
AG01FFK0
Chemical Name:
3-Bromo-5-ethyltoluene
CAS Number:
1208075-19-7
Molecular Formula:
C9H11Br
Molecular Weight:
199.0876
MDL Number:
MFCD12547777
IUPAC Name:
1-bromo-3-ethyl-5-methylbenzene
InChI:
InChI=1S/C9H11Br/c1-3-8-4-7(2)5-9(10)6-8/h4-6H,3H2,1-2H3
InChI Key:
GHSIXUBBYMWOOU-UHFFFAOYSA-N
SMILES:
CCc1cc(C)cc(c1)Br
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.004g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.091g/mol
Monoisotopic Mass:
198.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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