2-Chloro-N-benzylacetamide - CAS 2564-06-9
Catalog: |
BB018984 |
Product Name: |
2-Chloro-N-benzylacetamide |
CAS: |
2564-06-9 |
Synonyms: |
N-benzyl-2-chloroacetamide |
IUPAC Name: | N-benzyl-2-chloroacetamide |
Description: | N-Benzyl-2-chloroacetamide can be nerve rehabilitation effect for treating cerebral apoplexy. |
Molecular Weight: | 183.63 |
Molecular Formula: | C9H10ClNO |
Canonical SMILES: | C1=CC=C(C=C1)CNC(=O)CCl |
InChI: | InChI=1S/C9H10ClNO/c10-6-9(12)11-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12) |
InChI Key: | SRAXAXHQMCQHSH-UHFFFAOYSA-N |
Boiling Point: | 367.5 °C at 760 mmHg |
Density: | 1.176 g/cm3 |
MDL: | MFCD00084929 |
LogP: | 1.93250 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
21581091 | 20081031 | N,N'-Dibenzyl-2,2'-[(1,3,4-oxadiazole-2,5-di-yl)bis-(o-phenyl-eneoxy)]diacet-amide | Acta crystallographica. Section E, Structure reports online |
Complexity: | 144 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.0450916 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.0450916 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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