4-Chloro-N-methoxy-N-methylbenzamide - CAS 122334-37-6
Catalog: |
BB005391 |
Product Name: |
4-Chloro-N-methoxy-N-methylbenzamide |
CAS: |
122334-37-6 |
Synonyms: |
4-chloro-N-methoxy-N-methylbenzamide; 4-chloro-N-methoxy-N-methylbenzamide |
IUPAC Name: | 4-chloro-N-methoxy-N-methylbenzamide |
Description: | 4-Chloro-N-methoxy-N-methylbenzamide (CAS# 122334-37-6) is a derivative of Ketamine (K165300), which is an anesthetic (intravenous). |
Molecular Weight: | 199.63 |
Molecular Formula: | C9H10ClNO2 |
Canonical SMILES: | CN(C(=O)C1=CC=C(C=C1)Cl)OC |
InChI: | InChI=1S/C9H10ClNO2/c1-11(13-2)9(12)7-3-5-8(10)6-4-7/h3-6H,1-2H3 |
InChI Key: | LHUOAIXJPPMULP-UHFFFAOYSA-N |
Boiling Point: | 334.2 °C at 760 mmHg |
Density: | 1.224 g/cm3 |
Appearance: | Low melting solid |
Storage: | Sealed in dry, Room Temperature |
LogP: | 1.97340 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110563690-A | Tree ketonic acid A structural analogue, composition thereof and application thereof in medicines | 20160513 |
CN-106397207-B | Tree ketonic acid A structural analogue, composition thereof and application thereof in medicines | 20160513 |
US-2017057925-A1 | Indazole derivatives useful as cb-1 inverse agonists | 20150825 |
US-9682940-B2 | Indazole derivatives useful as CB-1 inverse agonists | 20150825 |
WO-2017034872-A1 | Indazole derivatives useful as cb-1 inverse agonists | 20150825 |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.0400063 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.0400063 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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