| CAS Number | 160841-03-2 |
| Catalog Number | AG001VF1(AGN-PC-0Q7YE3) |
| Chemical Name | (2R,3R)-2-AMINO-3-PHENYLMETHOXY-1-BUTANOL |
| IUPAC Name | (2R,3R)-2-amino-3-phenylmethoxybutan-1-ol;hydrochloride |
| InChI | InChI=1S/C11H17NO2.ClH/c1-9(11(12)7-13)14-8-10-5-3-2-4-6-10;/h2-6,9,11,13H,7-8,12H2,1H3;1H/t9-,11-;/m1./s1 |
| InChI Key | RSLDOTRVZGNKPQ-FOKYBFFNSA-N |
| MDL Number | MFCD00235947 |
| Molecular Formula | C11H18ClNO2 |
| Molecular Weight | 231.7191 |
| SMILES | Cl.N[C@H](CO)[C@@H](C)OCC1=CC=CC=C1 |
| Synonyms | 160841-03-2,
H-Threoninol(Bzl).HCl,
(2R,3R)-2-Amino-3-(benzyloxy)butan-1-ol hydrochloride,
O-BENZYL-L-THREONINOL HYDROCHLORIDE,
H-Thr(Bzl)-ol,
ANW-58870,
MFCD09250869,
AKOS016002106,
AX8044587,
RT-022827,
(2R,3R)-2-Amino-3-(phenylmethoxy)-1-butanol hydrochloride,
1-Butanol, 2-amino-3-(phenylmethoxy)-, hydrochloride, (2R,3R)- (9CI),
RSLDOTRVZGNKPQ-FOKYBFFNSA-N,
(2R,3R)-2-Amino-3-(benzyloxy)butan-1-olhydrochloride,
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| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.72g/mol |
| Monoisotopic Mass | 231.103g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 55.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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