| CAS Number | 143394-39-2 |
| Catalog Number | AG009Z9I(AGN-PC-0PTXAN) |
| Chemical Name | (S)-2-(Methylamino)-2-Phenylethanol |
| IUPAC Name | (2S)-2-(methylamino)-2-phenylethanol |
| InChI | InChI=1S/C9H13NO/c1-10-9(7-11)8-5-3-2-4-6-8/h2-6,9-11H,7H2,1H3/t9-/m1/s1 |
| InChI Key | ULIMZYAYESNNIP-SECBINFHSA-N |
| MDL Number | MFCD09827948 |
| Molecular Formula | C9H13NO |
| Molecular Weight | 151.2056 |
| SMILES | CN[C@@H](C1=CC=CC=C1)CO |
| Synonyms | (S)-2-(Methylamino)-2-phenylethanol,
143394-39-2,
(2S)-2-(methylamino)-2-phenylethan-1-ol,
SCHEMBL4110424,
DTXSID00434806,
ULIMZYAYESNNIP-SECBINFHSA-N,
7034AA,
FCH873096,
MFCD09827948,
ZINC38121198,
AKOS006326390,
LS30210,
AJ-94545,
AK122947,
AX8247125,
F1909-1616,
C9H13NO,
(2S)-2-methylamino-2-phenyl-ethanol,
CID10057687,
(S)-2-(METHYLAMINO)-2-PHENYLETHANOL HCl,
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| Complexity | 99.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.209g/mol |
| Monoisotopic Mass | 151.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number