(S)-2-Amino-2-(3-ethoxy-4-methoxyphenyl)ethanol - CAS 1213876-98-2
Catalog: |
BB054930 |
Product Name: |
(S)-2-Amino-2-(3-ethoxy-4-methoxyphenyl)ethanol |
CAS: |
1213876-98-2 |
Synonyms: |
(S)-2-Amino-2-(3-ethoxy-4-methoxyphenyl)ethanol; (2S)-2-amino-2-(3-ethoxy-4-methoxyphenyl)ethanol; (2S)-2-Amino-2-(3-ethoxy-4-methoxy-phenyl)ethanol; (betaS)-beta-Amino-3-ethoxy-4-methoxybenzeneethanol |
IUPAC Name: | (2S)-2-amino-2-(3-ethoxy-4-methoxyphenyl)ethanol |
Description: | (S)-2-Amino-2-(3-ethoxy-4-methoxyphenyl)ethanol is used as a reactant in the preparation of an isoindoline compound. |
Molecular Weight: | 211.26 |
Molecular Formula: | C11H17NO3 |
Canonical SMILES: | CCOC1=C(C=CC(=C1)C(CO)N)OC |
InChI: | InChI=1S/C11H17NO3/c1-3-15-11-6-8(9(12)7-13)4-5-10(11)14-2/h4-6,9,13H,3,7,12H2,1-2H3/t9-/m1/s1 |
InChI Key: | HAYDEVYSDHZRMI-SECBINFHSA-N |
Complexity: | 177 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.1208434 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.1208434 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 64.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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