Methyl 3-amino-2-methylbenzoate - CAS 18583-89-6
Catalog: |
BB014246 |
Product Name: |
Methyl 3-amino-2-methylbenzoate |
CAS: |
18583-89-6 |
Synonyms: |
methyl 3-amino-2-methylbenzoate |
IUPAC Name: | methyl 3-amino-2-methylbenzoate |
Description: | Methyl 3-Amino-2-methylbenzoate can be used in petroleum recovery process. |
Molecular Weight: | 165.19 |
Molecular Formula: | C9H11NO2 |
Canonical SMILES: | CC1=C(C=CC=C1N)C(=O)OC |
InChI: | InChI=1S/C9H11NO2/c1-6-7(9(11)12-2)4-3-5-8(6)10/h3-5H,10H2,1-2H3 |
InChI Key: | ZOOQFAUFPWXUMI-UHFFFAOYSA-N |
Boiling Point: | 300 °C |
Density: | 1.146 g/cm3 |
MDL: | MFCD00211328 |
LogP: | 1.94500 |
GHS Hazard Statement: | H315 (97.62%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113511968-A | Synthesis process of 2-methyl-3-methoxybenzoic acid | 20210419 |
WO-2021018173-A1 | Adenosine receptor antagonist | 20190730 |
WO-2020261114-A1 | 2,3-dihydroquinazolin compounds as nav1.8 inhibitors | 20190627 |
CN-111606928-A | Azacyclodiketone compound and preparation method thereof | 20190222 |
CN-113347970-A | Compounds and compositions for treating conditions associated with NLRP activity | 20181024 |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.078978594 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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