Methyl 3-[Imino(methoxy)methyl]benzoate Hydrochloride - CAS 1154063-16-7
Catalog: |
BB003560 |
Product Name: |
Methyl 3-[Imino(methoxy)methyl]benzoate Hydrochloride |
CAS: |
1154063-16-7 |
Synonyms: |
3-[imino(methoxy)methyl]benzoic acid methyl ester;hydrochloride; methyl 3-(C-methoxycarbonimidoyl)benzoate;hydrochloride |
IUPAC Name: | methyl 3-(C-methoxycarbonimidoyl)benzoate;hydrochloride |
Description: | Methyl 3-[Imino(methoxy)methyl]benzoate Hydrochloride (CAS# 1154063-16-7 ) is a useful research chemical. |
Molecular Weight: | 229.66 |
Molecular Formula: | C10H12ClNO3 |
Canonical SMILES: | COC(=N)C1=CC(=CC=C1)C(=O)OC.Cl |
InChI: | InChI=1S/C10H11NO3.ClH/c1-13-9(11)7-4-3-5-8(6-7)10(12)14-2;/h3-6,11H,1-2H3;1H |
InChI Key: | IILHNVRSXRFFIY-UHFFFAOYSA-N |
LogP: | 2.34670 |
Publication Number | Title | Priority Date |
CA-2582885-A1 | Compounds for nonsense suppression, use of these compounds for the manufacture of a medicament for treating somatic mutation-related diseases | 20041013 |
EP-1812071-A2 | Compounds for nonsense suppression, use of these compounds for the manufacture of a medicament for treating somatic mutation-related diseases | 20041013 |
EP-1815206-A1 | Compounds for nonsense suppression, and methods for their use | 20041013 |
EP-1815206-B1 | Compounds for nonsense suppression, and methods for their use | 20041013 |
EP-2301536-A1 | Pyrazole or triazole compounds and their use for the manufacture of a medicament for treating somatic mutation-related diseases | 20041013 |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.0505709 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.0505709 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 59.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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