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694-50-8 | Pyridine, 1,2,3,6-tetrahydro-4-methyl-
CAS No: 694-50-8 Catalog No: AG003U24 MDL No:MFCD19216910
Product Description
Catalog Number:
AG003U24
Chemical Name:
Pyridine, 1,2,3,6-tetrahydro-4-methyl-
CAS Number:
694-50-8
Molecular Formula:
C6H11N
Molecular Weight:
97.1582
MDL Number:
MFCD19216910
IUPAC Name:
4-methyl-1,2,3,6-tetrahydropyridine
InChI:
InChI=1S/C6H11N/c1-6-2-4-7-5-3-6/h2,7H,3-5H2,1H3
InChI Key:
IZGVOANXLNJMDM-UHFFFAOYSA-N
SMILES:
CC1=CCNCC1
Properties
Complexity:
84.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
97.089g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
97.161g/mol
Monoisotopic Mass:
97.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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