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22917-02-8 | Methane, tribromo-, compd. with benzene (1:1)
CAS No: 22917-02-8 Catalog No: AG002LI9 MDL No:
Product Description
Catalog Number:
AG002LI9
Chemical Name:
Methane, tribromo-, compd. with benzene (1:1)
CAS Number:
22917-02-8
Molecular Formula:
C7H7Br3
Molecular Weight:
330.8425
IUPAC Name:
benzene;bromoform
InChI:
InChI=1S/C6H6.CHBr3/c1-2-4-6-5-3-1;2-1(3)4/h1-6H;1H
InChI Key:
KUZPBXLLTIPSJA-UHFFFAOYSA-N
SMILES:
c1ccccc1.BrC(Br)Br
Properties
Complexity:
23.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.808g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.845g/mol
Monoisotopic Mass:
327.81g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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