rac-Cyclohexylalaninol Hydrochloride - CAS 82867-37-6
Catalog: |
BB069033 |
Product Name: |
rac-Cyclohexylalaninol Hydrochloride |
CAS: |
82867-37-6 |
Synonyms: |
β-Aminocyclohexanepropanol Hydrochloride |
IUPAC Name: | 2-amino-3-cyclohexylpropan-1-olhydrochloride |
Description: | rac-Cyclohexylalaninol Hydrochloride is used as a reagent in the synthesis of formyl-substituted pseudo-peptides with antiviral action. |
Molecular Weight: | 193.71 |
Molecular Formula: | C9H20ClNO |
Canonical SMILES: | C1CCC(CC1)CC(CO)N.Cl |
InChI: | InChI=1S/C9H19NO.ClH/c10-9(7-11)6-8-4-2-1-3-5-8/h8-9,11H,1-7,10H21H |
InChI Key: | BMHYDTXNZNVADC-UHFFFAOYSA-N |
References: | Raddatz, S., et al. PCT Int. Appl. WO 9730077 A1 19970821. Aug 21, 1997. |
Complexity: | 99.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.123342 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.123342 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.2Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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