7-Methoxyindoline - CAS 334986-99-1
Catalog: |
BB021744 |
Product Name: |
7-Methoxyindoline |
CAS: |
334986-99-1 |
Synonyms: |
7-methoxy-2,3-dihydro-1H-indole; 7-methoxy-2,3-dihydro-1H-indole |
IUPAC Name: | 7-methoxy-2,3-dihydro-1H-indole |
Description: | 7-Methoxyindoline (CAS# 334986-99-1) is a useful research chemical. |
Molecular Weight: | 149.19 |
Molecular Formula: | C9H11NO |
Canonical SMILES: | COC1=CC=CC2=C1NCC2 |
InChI: | InChI=1S/C9H11NO/c1-11-8-4-2-3-7-5-6-10-9(7)8/h2-4,10H,5-6H2,1H3 |
InChI Key: | QLVATPFLTCNUBR-UHFFFAOYSA-N |
LogP: | 1.80120 |
GHS Hazard Statement: | 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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2019112268-A1 | mTORC1 MODULATORS | 20171013 |
WO-2019075386-A1 | MODULATORS OF MTORC1 | 20171013 |
US-10807951-B2 | mTORC1 modulators | 20171013 |
EP-2975026-A1 | Method of nitrosation of organic compound | 20140717 |
CA-2876443-A1 | Novel adamantyl derivatives as cannabinoid receptor 2 agonists | 20120704 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 149.084063974 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 149.084063974 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 21.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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