Methyl 2-amino-5-chloro-4-methoxybenzoate - CAS 79025-26-6
Catalog: |
BB054135 |
Product Name: |
Methyl 2-amino-5-chloro-4-methoxybenzoate |
CAS: |
79025-26-6 |
Synonyms: |
methyl-4-methoxy-5-chloroanthranilate |
IUPAC Name: | methyl 2-amino-5-chloro-4-methoxybenzoate |
Molecular Weight: | 215.63 |
Molecular Formula: | C9H10ClNO3 |
Canonical SMILES: | COC1=C(C=C(C(=C1)N)C(=O)OC)Cl |
InChI: | InChI=1S/C9H10ClNO3/c1-13-8-4-7(11)5(3-6(8)10)9(12)14-2/h3-4H,11H2,1-2H3 |
InChI Key: | FDBZAKKAQHQRLI-UHFFFAOYSA-N |
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: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.0349209 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.0349209 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 61.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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