1,2,3,4-Tetrahydro-1-methyl-6-quinolinemethanol - CAS 68031-99-2
Catalog: |
BB057571 |
Product Name: |
1,2,3,4-Tetrahydro-1-methyl-6-quinolinemethanol |
CAS: |
68031-99-2 |
Synonyms: |
6-(Chloromethyl)-1-methyl-1,2,3,4-tetrahydroquinoline |
IUPAC Name: | (1-methyl-3,4-dihydro-2H-quinolin-6-yl)methanol |
Description: | A tetrahydroquinolinecarboxaldehyde derivative used in the synthesis of stilbenes. |
Molecular Weight: | 177.24 |
Molecular Formula: | C11H15NO |
Canonical SMILES: | CN1CCCC2=C1C=CC(=C2)CO |
InChI: | InChI=1S/C11H15NO/c1-12-6-2-3-10-7-9(8-13)4-5-11(10)12/h4-5,7,13H,2-3,6,8H2,1H3 |
InChI Key: | KWTAHNFGMCBZLB-UHFFFAOYSA-N |
References: | Roth, B., et al. J. Med. Chem., 24, 933 (1981),. |
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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
EP-2683710-A1 | Soluble guanylate cyclase activators | 20110310 |
EP-2683710-B1 | Soluble guanylate cyclase activators | 20110310 |
JP-2014507478-A | Soluble guanylate cyclase activator | 20110310 |
JP-5715713-B2 | Soluble guanylate cyclase activator | 20110310 |
US-2013065918-A1 | Soluble guanylate cyclase activators | 20110310 |
US-8569339-B2 | Soluble guanylate cyclase activators | 20110310 |
WO-2012122340-A1 | Soluble guanylate cyclase activators | 20110310 |
EP-2902030-A1 | Thienotriazolodiazepine compounds for treating neoplasia | 20100514 |
EP-2902030-B1 | Thienotriazolodiazepine compounds for treating neoplasia | 20100514 |
US-6362188-B1 | Farnesyl protein transferase inhibitors | 19981218 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.115364102 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 23.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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