3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one - CAS 3040-34-4
Catalog: |
BB063997 |
Product Name: |
3-Hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one |
CAS: |
3040-34-4 |
Synonyms: |
3-Hydroxy-3-methyloxindole; 3-Methyldioxyindole; 3-hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one; 3-hydroxy-3-methyl-1H-indol-2-one; 2H-Indol-2-one, 1,3-dihydro-3-hydroxy-3-methyl-; 3-hydroxy-3-methyl-1,3-dihydro-2H-indol-2-one; 3-Methyldioxindole; 3-hydroxy-3-methyl-Oxindole |
IUPAC Name: | 3-hydroxy-3-methyl-1H-indol-2-one |
Description: | 3-hydroxy-3-methyl-2,3-dihydro-1H-indol-2-one (cas# 3040-34-4) is a useful research chemical. |
Molecular Weight: | 163.17 |
Molecular Formula: | C9H9NO2 |
Canonical SMILES: | CC1(C2=CC=CC=C2NC1=O)O |
InChI: | InChI=1S/C9H9NO2/c1-9(12)6-4-2-3-5-7(6)10-8(9)11/h2-5,12H,1H3,(H,10,11) |
InChI Key: | XCHBYBKNFIOSBB-UHFFFAOYSA-N |
Appearance: | Solid |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
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: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.06332853 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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