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Basic Information
CAS No.: 120739-77-7
Name: 2-Chloro-5-ethylaminomethylpyridine
Article Data: 15
Molecular Structure:
Molecular Structure of 120739-77-7 (2-Chloro-5-ethylaminomethylpyridine)
Formula: C8H11ClN2
Molecular Weight: 170.642
Synonyms: 2-Chloro-5-(ethylaminomethyl)pyridine;2-Chloro-5-ethylaminoethylpyridine;N-((6-Chloropyridin-3-yl)methyl)ethanamine;N-(6-Chloro-3-pyridylmethyl)-N-ethylamine;
Density: 1.117
Boiling Point: 254℃
Flash Point: 108℃
PSA: 24.92000
LogP: 2.23540
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Specification

The 2-Chloro-5-ethylaminomethylpyridine, also known as AG-D-45257, is the organic compound with the formula C8H11ClN2. With the CAS registry number 120739-77-7, its IUPAC name is N-[(6-chloropyridin-3-yl)methyl]ethanamine.

Physical properties of 2-Chloro-5-ethylaminomethylpyridine: (1)XLogP3-AA: 1.5; (2)H-Bond Donor: 1; (3)H-Bond Acceptor: 2; (4)Rotatable Bond Count: 3; (5)Exact Mass: 170.061076; (6)MonoIsotopic Mass: 170.061076; (7)Topological Polar Surface Area: 24.9; (8)Heavy Atom Count: 11; (9)Formal Charge: 0; (10)Complexity: 108; (11)Isotope Atom Count: 0; (12)Covalently-Bonded Unit Count: 1.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCNCC1=CN=C(C=C1)Cl
(2)InChI: InChI=1S/C8H11ClN2/c1-2-10-5-7-3-4-8(9)11-6-7/h3-4,6,10H,2,5H2,1H3
(3)InChIKey: VLDUMLMCDDLHCN-UHFFFAOYSA-N