Home Halogens 1-bromo-3-(methyl-d3)benzene

1-bromo-3-(methyl-d3)benzene

CAS No.:
15169-02-5
Catalog Number:
AG01C9SX
Molecular Formula:
C7H4BrD3
Molecular Weight:
174.0530
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Product Description
Catalog Number:
AG01C9SX
Chemical Name:
1-bromo-3-(methyl-d3)benzene
CAS Number:
15169-02-5
Molecular Formula:
C7H4BrD3
Molecular Weight:
174.0530
MDL Number:
MFCD12760279
IUPAC Name:
1-bromo-3-(trideuteriomethyl)benzene
InChI:
InChI=1S/C7H7Br/c1-6-3-2-4-7(8)5-6/h2-5H,1H3/i1D3
InChI Key:
WJIFKOVZNJTSGO-FIBGUPNXSA-N
SMILES:
Brc1cccc(c1)C([2H])([2H])[2H]
Properties
Complexity:
70.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.992g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
3  
Molecular Weight:
174.055g/mol
Monoisotopic Mass:
172.992g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties