Methyl 3-Aminocyclohexane-1-carboxylate Hydrochloride - CAS 712317-18-5
Catalog: |
BB060066 |
Product Name: |
Methyl 3-Aminocyclohexane-1-carboxylate Hydrochloride |
CAS: |
712317-18-5 |
Synonyms: |
3-Aminocyclohexan-1-carboxylic Acid Methyl Ester Hydrochloride; 3-Aminocyclohexanecarboxylic Scid Methyl Ester Hydrochloride; Methyl 3-Aminocyclohexanecarboxylate Hydrochloride |
IUPAC Name: | methyl 3-aminocyclohexane-1-carboxylatehydrochloride |
Description: | Methyl 3-Aminocyclohexane-1-carboxylate is an intermediate used to prepare isophthalates as cardiovascular agents. |
Molecular Weight: | 193.67 |
Molecular Formula: | C8H16ClNO2 |
Canonical SMILES: | COC(=O)C1CCCC(C1)N.Cl |
InChI: | InChI=1S/C8H15NO2.ClH/c1-11-8(10)6-3-2-4-7(9)5-6/h6-7H,2-5,9H2,1H31H |
InChI Key: | OOFXENVWECZJBF-UHFFFAOYSA-N |
References: | Haerter, M., et al. PCT Int. Appl., WO 2004052839 A1 20040624 (2004). |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020216445-A1 | Tetrahydro-imidazo quinoline compositions as cbp/p300 inhibitors | 20170915 |
WO-2019055877-A1 | TETRAHYDROIMIDAZO QUINOLINE COMPOSITIONS AS INHIBITORS OF CBP / P300 | 20170915 |
EP-3681885-A1 | Tetrahydro-imidazo quinoline compositions as cbp/p300 inhibitors | 20170915 |
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US-2017326128-A1 | Novel Methyl-Piperidine Compounds Useful for Inhibiting Microsomal Prostaglandin E2 Synthase-1 | 20141029 |
US-2018250282-A1 | Novel Methyl-Piperidine Compounds Useful for Inhibiting Microsomal Prostaglandin E2 Synthase-1 | 20141029 |
US-9962375-B2 | Methyl-piperidine compounds useful for inhibiting microsomal prostaglandin E2 synthase-1 | 20141029 |
CN-107074829-B | For inhibiting microsomal prostaglandin E2Novel methyl-piperidine compounds of synthetase-1 | 20141029 |
WO-2013090929-A1 | Amino quinoline derivatives inhibitors of hcv | 20111215 |
KR-101880966-B1 | Compositions and Methods for the Production of Pyrimidine and Pyridine Compounds with BTK Inhibitory Activity | 20110610 |
Complexity: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.0869564 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.0869564 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.3Ų |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
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