N-Boc-(R)-phenylephrine - CAS 82212-44-0
Catalog: |
BB072440 |
Product Name: |
N-Boc-(R)-phenylephrine |
CAS: |
82212-44-0 |
Synonyms: |
tert-Butyl (R)-(2-hydroxy-2-(3-hydroxyphenyl)ethyl)(methyl)carbamate; tert-butyl N-[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-N-methylcarbamate |
IUPAC Name: | tert-butyl N-[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-N-methylcarbamate |
Molecular Weight: | 267.32 |
Molecular Formula: | C14H21NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)N(C)CC(C1=CC(=CC=C1)O)O |
InChI: | InChI=1S/C14H21NO4/c1-14(2,3)19-13(18)15(4)9-12(17)10-6-5-7-11(16)8-10/h5-8,12,16-17H,9H2,1-4H3/t12-/m0/s1 |
InChI Key: | YZDJRNBSGKONQP-LBPRGKRZSA-N |
Solubility: | Acetone, Ethyl Acetate, DCM |
Appearance: | Thick Oil |
Storage: | -20°C |
Complexity: | 300 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 267.14705815 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 267.14705815 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 70Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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