3,5-Dimethoxy-N-methylbenzylamine - CAS 77775-71-4
Catalog: |
BB036031 |
Product Name: |
3,5-Dimethoxy-N-methylbenzylamine |
CAS: |
77775-71-4 |
Synonyms: |
1-(3,5-dimethoxyphenyl)-N-methylmethanamine; 1-(3,5-dimethoxyphenyl)-N-methylmethanamine |
IUPAC Name: | 1-(3,5-dimethoxyphenyl)-N-methylmethanamine |
Description: | 3,5-Dimethoxy-N-methylbenzylamine (CAS# 77775-71-4) is a useful research chemical. |
Molecular Weight: | 181.23 |
Molecular Formula: | C10H15NO2 |
Canonical SMILES: | CNCC1=CC(=CC(=C1)OC)OC |
InChI: | InChI=1S/C10H15NO2/c1-11-7-8-4-9(12-2)6-10(5-8)13-3/h4-6,11H,7H2,1-3H3 |
InChI Key: | AZLYFFWKOFXIRJ-UHFFFAOYSA-N |
LogP: | 1.81410 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2020055824-A1 | Wdr5-mll1 inhibitors and modulators | 20180816 |
US-10807959-B2 | WDR5-MLL1 inhibitors and modulators | 20180816 |
WO-2019242689-A1 | Cyano-substituted pyridine and cyano-substituted pyrimidine compound, and preparation method and application thereof | 20180622 |
US-2020102288-A1 | Wdr5 inhibitors and modulators | 20180614 |
US-10844044-B2 | WDR5 inhibitors and modulators | 20180614 |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.110278721 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 30.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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