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101308-61-6 | Pyridine, 2-[2-(4-bromobutoxy)ethyl]-
CAS No: 101308-61-6 Catalog No: AG000479 MDL No:
Product Description
Catalog Number:
AG000479
Chemical Name:
Pyridine, 2-[2-(4-bromobutoxy)ethyl]-
CAS Number:
101308-61-6
Molecular Formula:
C11H16BrNO
Molecular Weight:
258.1548
IUPAC Name:
2-[2-(4-bromobutoxy)ethyl]pyridine
InChI:
InChI=1S/C11H16BrNO/c12-7-2-4-9-14-10-6-11-5-1-3-8-13-11/h1,3,5,8H,2,4,6-7,9-10H2
InChI Key:
HPPOESVYAIYQLF-UHFFFAOYSA-N
SMILES:
BrCCCCOCCc1ccccn1
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.042g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.159g/mol
Monoisotopic Mass:
257.042g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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