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6311-84-8 | 2-[2-(1H-pyrrol-1-yl)ethyl]pyridine
CAS No: 6311-84-8 Catalog No: AG00EY7F MDL No:MFCD00119337
Product Description
Catalog Number:
AG00EY7F
Chemical Name:
2-[2-(1H-pyrrol-1-yl)ethyl]pyridine
CAS Number:
6311-84-8
Molecular Formula:
C11H12N2
Molecular Weight:
172.2264
MDL Number:
MFCD00119337
IUPAC Name:
2-(2-pyrrol-1-ylethyl)pyridine
InChI:
InChI=1S/C11H12N2/c1-2-7-12-11(5-1)6-10-13-8-3-4-9-13/h1-5,7-9H,6,10H2
InChI Key:
FIVQLUUKBVMTHL-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)CCn1cccc1
NSC Number:
42638
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.231g/mol
Monoisotopic Mass:
172.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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