2- (4-chlorobutyl) pyridine

CAT: 1596-AR-T02373-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-T02373-01Size:10 Units

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CAS Number

237763-52-9

Synonyms

2- (4-chlorobutyl) pyridine

Molecular Formula

C9H12ClN

Molecular Weight

169.65

API Name

Tirofiban

Chemical Information

2-(4-Chlorobutyl)-pyridine

CAS Number	237763-52-9
PubChem CID	15398903
IUPAC Name	2-(4-chlorobutyl)pyridine
Molecular Formula	C9H12ClN
Molecular Weight	169.65
XLogP	2.1
Topological Polar Surface Area	12.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	11
Formal Charge	0
Complexity	95

SMILES

C1=CC=NC(=C1)CCCCCl

InChI

InChI=1S/C9H12ClN/c10-7-3-1-5-9-6-2-4-8-11-9/h2,4,6,8H,1,3,5,7H2

InChIKey

PRLDZAAAMXWFMR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 237763-52-9

CID: 15398903

Formula: C9H12ClN

MW: 169.65

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	169.65
XLogP3	2.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	169.0658271
Monoisotopic Mass	169.0658271
Topological Polar Surface Area	12.9 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	95.6
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
AR-T02372-01	3- (4-chlorobutyl) pyridine
AR-T02345-01	4- (4-chlorobutyl) pyridine 1-oxide
AR-C04087-01	Cilostazol 5- (4-Chlorobutyl) Impurity
AR-B01977-01	7- (4-Chlorobutoxy) -1- (4-chlorobutyl) quinolin-2-one
AR-M02961-01	1- (4-Chlorobutyl) -7-hydroxyquinolin-2 (1H) -one
AR-D07753-01	2- (4-Methylbenzoyl) pyridine
AR-P03302-01	4- (2-Aminoethyl) pyridine
AR-D02453-01	4- (2-Aminoanilino) pyridine
AR-T02675-01	Pyridine-2,4-dicarbohydrazide
AR-P29514-01	2- (4-Chlorobenzyl) pyridine

Catalog	Name
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