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61293-33-2 | 4-tert-butyl-1,2,3,6-tetrahydropyridine
CAS No: 61293-33-2 Catalog No: AG01AEJV MDL No:MFCD19226334
Product Description
Catalog Number:
AG01AEJV
Chemical Name:
4-tert-butyl-1,2,3,6-tetrahydropyridine
CAS Number:
61293-33-2
Molecular Formula:
C9H17N
Molecular Weight:
139.2380
MDL Number:
MFCD19226334
IUPAC Name:
4-tert-butyl-1,2,3,6-tetrahydropyridine
InChI:
InChI=1S/C9H17N/c1-9(2,3)8-4-6-10-7-5-8/h4,10H,5-7H2,1-3H3
InChI Key:
XNTFFUPDYBDWCU-UHFFFAOYSA-N
SMILES:
CC(C1=CCNCC1)(C)C
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.242g/mol
Monoisotopic Mass:
139.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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