3-Aminophenyl-N-methylcarbamate - CAS 25635-94-3
Catalog: |
BB061499 |
Product Name: |
3-Aminophenyl-N-methylcarbamate |
CAS: |
25635-94-3 |
Synonyms: |
3-Amino-phenol Methylcarbamate (Ester); Methyl-carbamic Acid m-Aminophenyl Ester; m-Amino-phenol Methylcarbamate (Ester); NSC 128140; m-Aminophenyl Methyl Carbamate |
IUPAC Name: | (3-aminophenyl) N-methylcarbamate |
Description: | 3-Aminophenyl-N-methylcarbamate is an intermediate in the synthesis of Formetanate-d6, Hydrochloride (F692802). Formetanate is an insecticide and acaricide. |
Molecular Weight: | 166.18 |
Molecular Formula: | C8H10N2O2 |
Canonical SMILES: | CNC(=O)OC1=CC=CC(=C1)N |
InChI: | InChI=1S/C8H10N2O2/c1-10-8(11)12-7-4-2-3-6(9)5-7/h2-5H,9H2,1H3,(H,10,11) |
InChI Key: | HYJYKSOOVKZGKW-UHFFFAOYSA-N |
Solubility: | Methanol |
Appearance: | Dark Brown Solid |
References: | Ong, K., et al. Food Chem., 55, 153 (1996); Hislop, R., et al. Protection Ecol., 3, 157 (1981). |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.074227566 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 64.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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