| CAS Number | 95349-35-2 |
| Catalog Number | AG003BBA(AGN-PC-0WG3JU) |
| Chemical Name | (-)-Benzylmethylphenylsilylacetic Acid [for e.e. Determination by NMR] |
| IUPAC Name | 2-(benzyl-methyl-phenylsilyl)acetic acid |
| InChI | InChI=1S/C16H18O2Si/c1-19(13-16(17)18,15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2-11H,12-13H2,1H3,(H,17,18) |
| InChI Key | JIPQZCPYHVQEIZ-UHFFFAOYSA-N |
| MDL Number | MFCD00191393 |
| Molecular Formula | C16H18O2Si |
| Molecular Weight | 270.3984 |
| SMILES | C[Si](CC(O)=O)(CC1=CC=CC=C1)C1=CC=CC=C1 |
| Synonyms | 95349-35-2,
95373-54-9,
(+)-Benzylmethylphenylsilylacetic Acid,
2-(Benzyl(methyl)(phenyl)silyl)acetic acid,
Acetic acid, [methylphenyl(phenylmethyl)silyl]-,
MFCD00191393,
103803-94-7,
ACMC-20m6m1,
SCHEMBL7813912,
CTK0G6794,
(?)-Benzylmethylphenylsilylacetic acid,
AKOS027383833,
ZINC196366439,
(-)-Benzylmethylphenylsilylacetic Acid,
(+)-benzylmethylphenylsilylaceticacid,
-BENZYLMETHYLPHENYLSILYLACETICACID,
2-(benzyl-methyl-phenylsilyl)acetic acid,
B1720,
B1721,
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| Complexity | 293 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.403g/mol |
| Monoisotopic Mass | 270.108g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number