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4788-37-8 | N-BENZYL-N-ETHYLMETHYLAMINE
CAS No: 4788-37-8 Catalog No: AG003SS6 MDL No:MFCD00051914
Product Description
Catalog Number:
AG003SS6
Chemical Name:
N-BENZYL-N-ETHYLMETHYLAMINE
CAS Number:
4788-37-8
MDL Number:
MFCD00051914
IUPAC Name:
N-benzyl-N-methylethanamine
InChI:
InChI=1S/C10H15N/c1-3-11(2)9-10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3
InChI Key:
ABRGFZIXRKAUJS-UHFFFAOYSA-N
NSC Number:
66252
Properties
Complexity:
95
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.12g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.237g/mol
Monoisotopic Mass:
149.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Mapping and fitting the peripheral benzodiazepine receptor binding site by carboxamide derivatives. Comparison of different approaches to quantitative ligand-receptor interaction modeling. | Journal of medicinal chemistry 20010412 |
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