2,3-Dimethoxybenzylamine - CAS 4393-09-3
Catalog: |
BB025498 |
Product Name: |
2,3-Dimethoxybenzylamine |
CAS: |
4393-09-3 |
Synonyms: |
(2,3-dimethoxyphenyl)methanamine |
IUPAC Name: | (2,3-dimethoxyphenyl)methanamine |
Description: | 2,3-Dimethoxybenzylamine (CAS# 4393-09-3) is a useful research chemical. |
Molecular Weight: | 167.21 |
Molecular Formula: | C9H13NO2 |
Canonical SMILES: | COC1=CC=CC(=C1OC)CN |
InChI: | InChI=1S/C9H13NO2/c1-11-8-5-3-4-7(6-10)9(8)12-2/h3-5H,6,10H2,1-2H3 |
InChI Key: | LVMPWFJVYMXSNY-UHFFFAOYSA-N |
Boiling Point: | 137 °C (11 mmHg) |
Density: | 1.13 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00052392 |
LogP: | 1.86280 |
GHS Hazard Statement: | H315 (95.24%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111808121-A | Novel high-B-ring berberine analogue containing heteroatom and C-H activation synthesis method thereof | 20200630 |
CN-109608395-A | Transition metal-catalyzed C-H activation/cyclization reaction efficiently synthesizes the green syt new method of isoquinilone derivatives | 20181225 |
CN-109608395-B | Novel green synthesis method for efficiently synthesizing isoquinoline derivative through C-H activation/cyclization reaction catalyzed by transition metal | 20181225 |
WO-2020041556-A1 | N-substituted-1h-1,2,4-triazole-3-carboxamides, analogues thereof, and methods of treatment using same | 20180822 |
US-2021309618-A1 | N-substituted-1h-1,2,4-triazole-3-carboxamides, analogues thereof, and methods of treatment using same | 20180822 |
PMID | Publication Date | Title | Journal |
15369390 | 20040923 | Exploring the binding mode of semicarbazide-sensitive amine oxidase/VAP-1: identification of novel substrates with insulin-like activity | Journal of medicinal chemistry |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 167.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 167.094628657 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 44.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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