Methyl 2-(benzylamino)acetate hydrochloride - CAS 17136-35-5
Catalog: |
BB046702 |
Product Name: |
Methyl 2-(benzylamino)acetate hydrochloride |
CAS: |
17136-35-5 |
Synonyms: |
Bzl-Gly-OMe Hydrochloride; N-benzylglycine methyl ester Hydrochloride; Glycine, N-(phenylmethyl)-, methyl ester Hydrochloride; Methyl benzylglycinate hydrochloride; n-alfa-benzyl-glycine methyl ester HCl; NSC-145674; N-(Phenylmethyl)glycine methyl ester HCl; Benzyl glycine methyl ester hydrochloride |
Related CAS: | 53386-64-4 (free base)
|
IUPAC Name: | methyl 2-(benzylamino)acetate;hydrochloride |
Description: | Methyl 2-(benzylamino)acetate hydrochloride (CAS# 17136-35-5 ) is a useful research chemical. |
Molecular Weight: | 215.67 |
Molecular Formula: | C10H13NO2.HCl |
Canonical SMILES: | COC(=O)CNCC1=CC=CC=C1.Cl |
InChI: | InChI=1S/C10H13NO2.ClH/c1-13-10(12)8-11-7-9-5-3-2-4-6-9;/h2-6,11H,7-8H2,1H3;1H |
InChI Key: | KITLJURGIVERDS-UHFFFAOYSA-N |
Melting Point: | 133-140 °C |
Purity: | ≥ 99 % by HPLC |
Appearance: | White crystalline powder |
Storage: | Store at 2-8 °C |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.0713064 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.0713064 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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