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114474-05-4 | Benzoic acid, 2-[bromo(trimethylsilyl)methyl]-, methyl ester
CAS No: 114474-05-4 Catalog No: AG000EHN MDL No:
Product Description
Catalog Number:
AG000EHN
Chemical Name:
Benzoic acid, 2-[bromo(trimethylsilyl)methyl]-, methyl ester
CAS Number:
114474-05-4
Molecular Formula:
C12H17BrO2Si
Molecular Weight:
301.2517
IUPAC Name:
methyl 2-[bromo(trimethylsilyl)methyl]benzoate
InChI:
InChI=1S/C12H17BrO2Si/c1-15-12(14)10-8-6-5-7-9(10)11(13)16(2,3)4/h5-8,11H,1-4H3
InChI Key:
DACWDZKHTSKGNG-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccccc1C([Si](C)(C)C)Br
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.018g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.255g/mol
Monoisotopic Mass:
300.018g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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