2- (4-Butylphenyl) pyridine

CAT: 0127-OR1076318-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1076318-01Size:50 mg

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CAS Number

334988-37-3

MDL Number

MFCD07775633

Purity

98%

Smiles

CCCCC1=CC=C(C=C1)C2=CC=CC=N2

Chemical Information

2-(4-Butylphenyl)pyridine

CAS Number	334988-37-3
PubChem CID	20755399
IUPAC Name	2-(4-butylphenyl)pyridine
Molecular Formula	C15H17N
Molecular Weight	211.30
XLogP	4.5
Topological Polar Surface Area	12.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	16
Formal Charge	0
Complexity	182

SMILES

CCCCC1=CC=C(C=C1)C2=CC=CC=N2

InChI

InChI=1S/C15H17N/c1-2-3-6-13-8-10-14(11-9-13)15-7-4-5-12-16-15/h4-5,7-12H,2-3,6H2,1H3

InChIKey

ICLWPUMWHYNPFP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 334988-37-3

CID: 20755399

Formula: C15H17N

MW: 211.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	211.30
XLogP3	4.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	211.136099547
Monoisotopic Mass	211.136099547
Topological Polar Surface Area	12.9 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	182
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1015373-01	Tris (2- (4-Tert-Butylphenyl) Pyridine) Iridium
IN12460-01	Tris (2- (3-tert-butylphenyl) pyridine) iridium
OR1011150-01	4- (4-Tert-Butylphenyl) -2-Methylindene
OR1086930-01	3- (4-Butylphenyl) -2-propynal
OR1067765-01	2- (4-tert-Butylphenyl) acetaldehyde
OR88533-01	2- (4-Butylphenyl) propanoic acid
OR936878-01	2- (4-tert-Butylphenyl) ethanol
PC1023549-01	1- (4-Butylphenyl) -2,2-difluoroethanone
OR1093983	Ethyl 2- (4-butylphenyl) -2-oxoacetate
OR1058056-01	2- (4-Butylphenyl) propan-2-ol

Catalog	Name
sc-486801	2- (4-tert-Butylphenyl) pyridine
RRB54439-01	2-[ (4-tert-Butylphenyl) amino]pyridine-3-carbothioamide
UMB27891-01	4- (4-Iodophenoxymethyl) pyridine
sc-347948A	4- (4-bromophenoxy) pyridine
sc-261330A	4- (4-Carboxyphenyl) pyridine
sc-276744	4- (4-Chlorobenzyl) pyridine
PAA54848	4- (4-Chlorobenzoyl) pyridine
XAA24138-01	4- (4-Methylpentyl) pyridine
283955-01	4- (4-Methoxyphenyl) pyridine
sc-256628B	4- (4-Nitrobenzyl) pyridine