Home Pyridines 80866-95-1
80866-95-1,MFCD00006405
Catalog No.:AA003I7B
80866-95-1 | 3-((1H-Pyrrol-1-yl)methyl)pyridine
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1g
>97.0%(GC)(T)
1 week  
$153.00   $108.00
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5g
>97.0%(GC)(T)
1 week  
$549.00   $385.00
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Technical Information
Catalog Number:
AA003I7B
Chemical Name:
3-((1H-Pyrrol-1-yl)methyl)pyridine
CAS Number:
80866-95-1
Molecular Formula:
C10H10N2
Molecular Weight:
158.1998
MDL Number:
MFCD00006405
IUPAC Name:
3-(pyrrol-1-ylmethyl)pyridine
InChI:
InChI=1S/C10H10N2/c1-2-7-12(6-1)9-10-4-3-5-11-8-10/h1-8H,9H2
InChI Key:
PJVWPGGKILHMKW-UHFFFAOYSA-N
SMILES:
c1ccc(cn1)Cn1cccc1
EC Number:
279-598-2
Properties
Computed Properties
 
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.204g/mol
Monoisotopic Mass:
158.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Synonyms
 
3-(Pyrrol-1-ylmethyl)pyridine 
80866-95-1 
AC1LF4P6 
DivK1c_001406 
SCHEMBL4935379 
3-{pyrrol-1-ylmethyl} pyridine 
HMS549A14 
ZINC74128 
DTXSID80230762 
1-(3-Pyridylmethyl)-1H-pyrrole 
PJVWPGGKILHMKW-UHFFFAOYSA-N 
KS-000012FU 
3-(1H-Pyrrol-1-ylmethyl)pyridine 
CCG-52557 
GEO-02208 
MFCD00006405 
SBB003989 
STL353622 
AKOS000114037 
3-(Pyrrol-1-ylmethyl)pyridine, 97% 
MCULE-1632959723 
SDCCGMLS-0066088.P001 
ST023494 
3-((1H-pyrrol-1-yl)methyl)pyridine 
ZB002661 
TC-170133 
A9956 
FT-0613875 
P1853 
X-4134 
SR-01000641785-1 
I14-91449 
3- pyridine 
3-(1-Pyrrolylmethyl)pyridine 
3-(pyrrolylmethyl)pyridine 
2-Amino-4-fluorobenzonitrile 
AR-1E5916 
CID697607 
C10-H10-N2 
3-(Pyrrol-1-ylmethyl)pyridine, 98% - 1G 1g 
80517-22-2 
82204-92-0 
EINECS 279-598-2 
CDS1_000366 
AC1Q4WMX 
Maybridge1_002654 
ACMC-1BK8U 
Literature

Title: Dibenzoatobis[3-(pyrrol-1-ylmeth-yl)pyridine]-zinc(II).

Journal: Acta crystallographica. Section E, Structure reports online 20100801

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