Methyl 5-(aminomethyl)-2-methoxybenzoate hyrdochloride - CAS 1049782-92-4
Catalog: |
BB059446 |
Product Name: |
Methyl 5-(aminomethyl)-2-methoxybenzoate hyrdochloride |
CAS: |
1049782-92-4 |
Synonyms: |
methyl 5-(aminomethyl)-2-methoxybenzoate hydrochloride; Methyl 5-(aminomethyl)-2-methoxybenzoate, HCl; methyl 5-(aminomethyl)-2-methoxybenzoate; hydrochloride |
IUPAC Name: | methyl 5-(aminomethyl)-2-methoxybenzoatehydrochloride |
Description: | Methyl 5-(aminomethyl)-2-methoxybenzoate, HCl |
Molecular Weight: | 231.68 |
Molecular Formula: | C10H14ClNO3 |
Canonical SMILES: | COC1=C(C=C(C=C1)CN)C(=O)OC.Cl |
InChI: | InChI=1S/C10H13NO3.ClH/c1-13-9-4-3-7(6-11)5-8(9)10(12)14-2/h3-5H,6,11H2,1-2H31H |
InChI Key: | FWUSELINWADQCC-UHFFFAOYSA-N |
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 |
Complexity: | 196 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.066221 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.066221 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 61.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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