Bicyclo[3.1.1]heptane-3-carboxylic acid, 2-amino-6,6-dimethyl-, ethyl ester, hydrochloride (1:1), (1R,2R,3S,5R)-

CAS Registry Number®

1027343-58-3
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CAS Name

Bicyclo[3.1.1]heptane-3-carboxylic acid, 2-amino-6,6-dimethyl-, ethyl ester, hydrochloride (1:1), (1R,2R,3S,5R)-

Molecular Formula

C12H21NO2.ClH

Cite this Page

Bicyclo[3.1.1]heptane-3-carboxylic acid, 2-amino-6,6-dimethyl-, ethyl ester, hydrochloride (1:1), (1R,2R,3S,5R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1027343-58-3 (retrieved 2024-08-14) (CAS RN: 1027343-58-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    138-139 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H21NO2.ClH/c1-4-15-11(14)8-5-7-6-9(10(8)13)12(7,2)3;/h7-10H,4-6,13H2,1-3H3;1H/t7-,8-,9-,10-;/m0./s1

InChIKey

InChIKey=HOPRBAXUPWEUQB-AQZMEQOXSA-N

SMILES

CC1(C)[C@@]2([C@@H](N)[C@@H](C(OCC)=O)C[C@]1(C2)[H])[H].Cl

Canonical SMILES

Cl.O=C(OCC)C1CC2CC(C1N)C2(C)C

Other Names for this Substance

  • Bicyclo[3.1.1]heptane-3-carboxylic acid, 2-amino-6,6-dimethyl-, ethyl ester, hydrochloride (1:1), (1R,2R,3S,5R)-