CAS 1122-81-2 | 4-Propylpyridine | CAS Number 1122-81-2

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1122-81-2 | 4-Propylpyridine

CAS No: 1122-81-2 Catalog No: AG003M0C MDL No:MFCD00014639

Product Description

Catalog Number:

AG003M0C

Chemical Name:

4-Propylpyridine

CAS Number:

1122-81-2

Molecular Formula:

C8H11N

Molecular Weight:

121.1796

MDL Number:

MFCD00014639

IUPAC Name:

4-propylpyridine

InChI:

InChI=1S/C8H11N/c1-2-3-8-4-6-9-7-5-8/h4-7H,2-3H2,1H3

InChI Key:

JAWZAONCXMJLFT-UHFFFAOYSA-N

SMILES:

CCCc1ccncc1

EC Number:

214-360-3

UNII:

0RAV2AQL8R

NSC Number:

967

Properties

Complexity:

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

121.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

121.183g/mol

Monoisotopic Mass:

121.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

12.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
4-isopropylpyridine hydroperoxide crystals resulting from the aerobic oxidation of a 4-isopropylpyridine/4-propylpyridine mixture.	The journal of physical chemistry. B 20090409
Bis(benzoyl-acetonato)bis-(1,3-di-4-pyridyl-propane)manganese(II).	Acta crystallographica. Section E, Structure reports online 20090401
Crystal structure and EPR studies of mixed ligand complex of cobalt(II) with saccharin and ethylisonicotine.	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081215