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Home > Pyridines > 1055027-36-5
1055027-36-5 | rac-(2S,6R)-2,6-diallyl-1,2,3,6-tetrahydropyridine
CAS No: 1055027-36-5 Catalog No: AG00J3C7 MDL No:MFCD02068159
Product Description
Catalog Number:
AG00J3C7
Chemical Name:
rac-(2S,6R)-2,6-diallyl-1,2,3,6-tetrahydropyridine
CAS Number:
1055027-36-5
Molecular Formula:
C11H17N
Molecular Weight:
163.2594
MDL Number:
MFCD02068159
IUPAC Name:
(2S,6R)-2,6-bis(prop-2-enyl)-1,2,3,6-tetrahydropyridine
InChI:
InChI=1S/C11H17N/c1-3-6-10-8-5-9-11(12-10)7-4-2/h3-5,8,10-12H,1-2,6-7,9H2/t10-,11+/m1/s1
InChI Key:
GAYQJEALDMVJON-MNOVXSKESA-N
SMILES:
C=CC[C@H]1CC=C[C@H](N1)CC=C
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
163.136g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.264g/mol
Monoisotopic Mass:
163.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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