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156-41-2 | Benzeneethanamine, 4-chloro-
CAS No: 156-41-2 Catalog No: AG001OF6 MDL No:MFCD00008191
Product Description
Catalog Number:
AG001OF6
Chemical Name:
Benzeneethanamine, 4-chloro-
CAS Number:
156-41-2
Molecular Formula:
C8H10ClN
Molecular Weight:
155.6247
MDL Number:
MFCD00008191
IUPAC Name:
2-(4-chlorophenyl)ethanamine
InChI:
InChI=1S/C8H10ClN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5-6,10H2
InChI Key:
SRXFXCKTIGELTI-UHFFFAOYSA-N
SMILES:
NCCc1ccc(cc1)Cl
EC Number:
205-853-4
Properties
Complexity:
87.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.05g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.625g/mol
Monoisotopic Mass:
155.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| S-benzylisothiourea derivatives as small-molecule inhibitors of indoleamine-2,3-dioxygenase. | Bioorganic & medicinal chemistry letters 20100901 |
| Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1. | Bioorganic & medicinal chemistry 20080801 |
| Mitochondrial damage induced by fetal hyperphenylalaninemia in the rat brain and liver: its prevention by melatonin, Vitamin E, and Vitamin C. | Neuroscience letters 20060109 |
| Harmane inhibits serotonergic dorsal raphe neurons in the rat. | Psychopharmacology 20051101 |
| Neuropharmacology of the parasitic trematode, Schistosoma mansoni. | The American journal of tropical medicine and hygiene 19830101 |
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